Stevanović, Jelena

Link to this page

Authority KeyName Variants
e205979a-cc5d-40f3-b238-f19a9c721b7e
  • Stevanović, Jelena (6)
Projects

Author's Bibliography

Semi-rational design of cellobiose dehydrogenase for increased stability in the presence of peroxide

Balaž, Ana Marija; Stevanović, Jelena; Ostafe, Raluca; Blazić, Marija; Ilić Đurđić, Karla; Fischer, Rainer; Prodanović, Radivoje

(2020)

TY  - JOUR
AU  - Balaž, Ana Marija
AU  - Stevanović, Jelena
AU  - Ostafe, Raluca
AU  - Blazić, Marija
AU  - Ilić Đurđić, Karla
AU  - Fischer, Rainer
AU  - Prodanović, Radivoje
PY  - 2020
UR  - http://cherry.chem.bg.ac.rs/handle/123456789/4011
AB  - Cellobiose dehydrogenase (CDH, EC 1.1.99.18) from white rot fungi Phanerochaete chrysosporium can be used for constructing biosensors and biofuel cells, for bleaching cotton in textile industry, and recently, the enzyme has found an important application in biomedicine as an antimicrobial and antibiofilm agent. Stability and activity of the wild-type (wt) CDH and mutants at methionine residues in the presence of hydrogen peroxide were investigated. Saturation mutagenesis libraries were made at the only methionine in heme domain M65 and two methionines M685 and M738 in the flavin domain that were closest to the active site. After screening the libraries, three mutants with increased activity and stability in the presence of peroxide were found, M65F with 70% of residual activity after 6 h of incubation in 0.3 M hydrogen peroxide, M738S with 80% of residual activity and M685Y with over 90% of residual activity compared to wild-type CDH that retained 40% of original activity. Combined mutants showed no activity. The most stable mutant M685Y with 5.8 times increased half-life in the presence of peroxide showed also 2.5 times increased kcat for lactose compared to wtCDH and could be good candidate for applications in biofuel cells and biocatalysis for lactobionic acid production.
T2  - Molecular Diversity
T1  - Semi-rational design of cellobiose dehydrogenase for increased stability in the presence of peroxide
VL  - 24
IS  - 3
SP  - 593
EP  - 601
DO  - 10.1007/s11030-019-09965-0
ER  - 
@article{
author = "Balaž, Ana Marija and Stevanović, Jelena and Ostafe, Raluca and Blazić, Marija and Ilić Đurđić, Karla and Fischer, Rainer and Prodanović, Radivoje",
year = "2020",
url = "http://cherry.chem.bg.ac.rs/handle/123456789/4011",
abstract = "Cellobiose dehydrogenase (CDH, EC 1.1.99.18) from white rot fungi Phanerochaete chrysosporium can be used for constructing biosensors and biofuel cells, for bleaching cotton in textile industry, and recently, the enzyme has found an important application in biomedicine as an antimicrobial and antibiofilm agent. Stability and activity of the wild-type (wt) CDH and mutants at methionine residues in the presence of hydrogen peroxide were investigated. Saturation mutagenesis libraries were made at the only methionine in heme domain M65 and two methionines M685 and M738 in the flavin domain that were closest to the active site. After screening the libraries, three mutants with increased activity and stability in the presence of peroxide were found, M65F with 70% of residual activity after 6 h of incubation in 0.3 M hydrogen peroxide, M738S with 80% of residual activity and M685Y with over 90% of residual activity compared to wild-type CDH that retained 40% of original activity. Combined mutants showed no activity. The most stable mutant M685Y with 5.8 times increased half-life in the presence of peroxide showed also 2.5 times increased kcat for lactose compared to wtCDH and could be good candidate for applications in biofuel cells and biocatalysis for lactobionic acid production.",
journal = "Molecular Diversity",
title = "Semi-rational design of cellobiose dehydrogenase for increased stability in the presence of peroxide",
volume = "24",
number = "3",
pages = "593-601",
doi = "10.1007/s11030-019-09965-0"
}
Balaž, A. M., Stevanović, J., Ostafe, R., Blazić, M., Ilić Đurđić, K., Fischer, R.,& Prodanović, R. (2020). Semi-rational design of cellobiose dehydrogenase for increased stability in the presence of peroxide.
Molecular Diversity, 24(3), 593-601.
https://doi.org/10.1007/s11030-019-09965-0
Balaž AM, Stevanović J, Ostafe R, Blazić M, Ilić Đurđić K, Fischer R, Prodanović R. Semi-rational design of cellobiose dehydrogenase for increased stability in the presence of peroxide. Molecular Diversity. 2020;24(3):593-601
Balaž Ana Marija, Stevanović Jelena, Ostafe Raluca, Blazić Marija, Ilić Đurđić Karla, Fischer Rainer, Prodanović Radivoje, "Semi-rational design of cellobiose dehydrogenase for increased stability in the presence of peroxide" Molecular Diversity, 24, no. 3 (2020):593-601,
https://doi.org/10.1007/s11030-019-09965-0 .
4
1

Improved Flavin-Based Catalytic Photooxidation of Alcohols through Intersystem Crossing Rate Enhancement

Korvinson, Kirill A.; Hargenrader, George N.; Stevanović, Jelena; Xie, Yun; Joseph, Jojo; Maslak, Veselin; Hadad, Christopher M.; Glusac, Ksenija D.

(Amer Chemical Soc, Washington, 2016)

TY  - JOUR
AU  - Korvinson, Kirill A.
AU  - Hargenrader, George N.
AU  - Stevanović, Jelena
AU  - Xie, Yun
AU  - Joseph, Jojo
AU  - Maslak, Veselin
AU  - Hadad, Christopher M.
AU  - Glusac, Ksenija D.
PY  - 2016
UR  - http://cherry.chem.bg.ac.rs/handle/123456789/2315
AB  - The triplet excited-state formation efficiency in a flavin derivative was increased by the introduction of iodine into the molecular framework. The transient absorption measurements showed that the intersystem crossing rate was 1.1 X 10(10) s(-1) significantly faster than in the parent flavin compound. Furthermore, the photocatalytic efficiency of iodoflavin was evaluated using the oxidation of benzyl alcohol as a model reaction. The benzaldehyde product yields were higher when iodoflavin was used as a photocatalyst, showing that the increased triplet yield directly translates into improved photocatalysis. The iodoflavin catalyst also allowed the use of higher substrate concentrations (since the undesired electron transfer from singlet excited state was minimized), which is expected to improve the practical aspects of photocatalysis by flavins.
PB  - Amer Chemical Soc, Washington
T2  - Journal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th
T1  - Improved Flavin-Based Catalytic Photooxidation of Alcohols through Intersystem Crossing Rate Enhancement
VL  - 120
IS  - 37
SP  - 7294
EP  - 7300
DO  - 10.1021/acs.jpca.6b08405
ER  - 
@article{
author = "Korvinson, Kirill A. and Hargenrader, George N. and Stevanović, Jelena and Xie, Yun and Joseph, Jojo and Maslak, Veselin and Hadad, Christopher M. and Glusac, Ksenija D.",
year = "2016",
url = "http://cherry.chem.bg.ac.rs/handle/123456789/2315",
abstract = "The triplet excited-state formation efficiency in a flavin derivative was increased by the introduction of iodine into the molecular framework. The transient absorption measurements showed that the intersystem crossing rate was 1.1 X 10(10) s(-1) significantly faster than in the parent flavin compound. Furthermore, the photocatalytic efficiency of iodoflavin was evaluated using the oxidation of benzyl alcohol as a model reaction. The benzaldehyde product yields were higher when iodoflavin was used as a photocatalyst, showing that the increased triplet yield directly translates into improved photocatalysis. The iodoflavin catalyst also allowed the use of higher substrate concentrations (since the undesired electron transfer from singlet excited state was minimized), which is expected to improve the practical aspects of photocatalysis by flavins.",
publisher = "Amer Chemical Soc, Washington",
journal = "Journal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th",
title = "Improved Flavin-Based Catalytic Photooxidation of Alcohols through Intersystem Crossing Rate Enhancement",
volume = "120",
number = "37",
pages = "7294-7300",
doi = "10.1021/acs.jpca.6b08405"
}
Korvinson, K. A., Hargenrader, G. N., Stevanović, J., Xie, Y., Joseph, J., Maslak, V., Hadad, C. M.,& Glusac, K. D. (2016). Improved Flavin-Based Catalytic Photooxidation of Alcohols through Intersystem Crossing Rate Enhancement.
Journal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th
Amer Chemical Soc, Washington., 120(37), 7294-7300.
https://doi.org/10.1021/acs.jpca.6b08405
Korvinson KA, Hargenrader GN, Stevanović J, Xie Y, Joseph J, Maslak V, Hadad CM, Glusac KD. Improved Flavin-Based Catalytic Photooxidation of Alcohols through Intersystem Crossing Rate Enhancement. Journal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th. 2016;120(37):7294-7300
Korvinson Kirill A., Hargenrader George N., Stevanović Jelena, Xie Yun, Joseph Jojo, Maslak Veselin, Hadad Christopher M., Glusac Ksenija D., "Improved Flavin-Based Catalytic Photooxidation of Alcohols through Intersystem Crossing Rate Enhancement" Journal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th, 120, no. 37 (2016):7294-7300,
https://doi.org/10.1021/acs.jpca.6b08405 .
20
18
20

Improved Flavin-Based Catalytic Photooxidation of Alcohols through Intersystem Crossing Rate Enhancement

Korvinson, Kirill A.; Hargenrader, George N.; Stevanović, Jelena; Xie, Yun; Joseph, Jojo; Maslak, Veselin; Hadad, Christopher M.; Glusac, Ksenija D.

(Amer Chemical Soc, Washington, 2016)

TY  - JOUR
AU  - Korvinson, Kirill A.
AU  - Hargenrader, George N.
AU  - Stevanović, Jelena
AU  - Xie, Yun
AU  - Joseph, Jojo
AU  - Maslak, Veselin
AU  - Hadad, Christopher M.
AU  - Glusac, Ksenija D.
PY  - 2016
UR  - http://cherry.chem.bg.ac.rs/handle/123456789/3541
AB  - The triplet excited-state formation efficiency in a flavin derivative was increased by the introduction of iodine into the molecular framework. The transient absorption measurements showed that the intersystem crossing rate was 1.1 X 10(10) s(-1) significantly faster than in the parent flavin compound. Furthermore, the photocatalytic efficiency of iodoflavin was evaluated using the oxidation of benzyl alcohol as a model reaction. The benzaldehyde product yields were higher when iodoflavin was used as a photocatalyst, showing that the increased triplet yield directly translates into improved photocatalysis. The iodoflavin catalyst also allowed the use of higher substrate concentrations (since the undesired electron transfer from singlet excited state was minimized), which is expected to improve the practical aspects of photocatalysis by flavins.
PB  - Amer Chemical Soc, Washington
T2  - Journal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th
T1  - Improved Flavin-Based Catalytic Photooxidation of Alcohols through Intersystem Crossing Rate Enhancement
VL  - 120
IS  - 37
SP  - 7294
EP  - 7300
DO  - 10.1021/acs.jpca.6b08405
ER  - 
@article{
author = "Korvinson, Kirill A. and Hargenrader, George N. and Stevanović, Jelena and Xie, Yun and Joseph, Jojo and Maslak, Veselin and Hadad, Christopher M. and Glusac, Ksenija D.",
year = "2016",
url = "http://cherry.chem.bg.ac.rs/handle/123456789/3541",
abstract = "The triplet excited-state formation efficiency in a flavin derivative was increased by the introduction of iodine into the molecular framework. The transient absorption measurements showed that the intersystem crossing rate was 1.1 X 10(10) s(-1) significantly faster than in the parent flavin compound. Furthermore, the photocatalytic efficiency of iodoflavin was evaluated using the oxidation of benzyl alcohol as a model reaction. The benzaldehyde product yields were higher when iodoflavin was used as a photocatalyst, showing that the increased triplet yield directly translates into improved photocatalysis. The iodoflavin catalyst also allowed the use of higher substrate concentrations (since the undesired electron transfer from singlet excited state was minimized), which is expected to improve the practical aspects of photocatalysis by flavins.",
publisher = "Amer Chemical Soc, Washington",
journal = "Journal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th",
title = "Improved Flavin-Based Catalytic Photooxidation of Alcohols through Intersystem Crossing Rate Enhancement",
volume = "120",
number = "37",
pages = "7294-7300",
doi = "10.1021/acs.jpca.6b08405"
}
Korvinson, K. A., Hargenrader, G. N., Stevanović, J., Xie, Y., Joseph, J., Maslak, V., Hadad, C. M.,& Glusac, K. D. (2016). Improved Flavin-Based Catalytic Photooxidation of Alcohols through Intersystem Crossing Rate Enhancement.
Journal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th
Amer Chemical Soc, Washington., 120(37), 7294-7300.
https://doi.org/10.1021/acs.jpca.6b08405
Korvinson KA, Hargenrader GN, Stevanović J, Xie Y, Joseph J, Maslak V, Hadad CM, Glusac KD. Improved Flavin-Based Catalytic Photooxidation of Alcohols through Intersystem Crossing Rate Enhancement. Journal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th. 2016;120(37):7294-7300
Korvinson Kirill A., Hargenrader George N., Stevanović Jelena, Xie Yun, Joseph Jojo, Maslak Veselin, Hadad Christopher M., Glusac Ksenija D., "Improved Flavin-Based Catalytic Photooxidation of Alcohols through Intersystem Crossing Rate Enhancement" Journal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th, 120, no. 37 (2016):7294-7300,
https://doi.org/10.1021/acs.jpca.6b08405 .
20
18
20

Supplementary material for the article: Korvinson, K. A.; Hargenrader, G. N.; Stevanovic, J.; Xie, Y.; Joseph, J.; Maslak, V.; Hadad, C. M.; Glusac, K. D. Improved Flavin-Based Catalytic Photooxidation of Alcohols through Intersystem Crossing Rate Enhancement. Journal of Physical Chemistry A 2016, 120 (37), 7294–7300. https://doi.org/10.1021/acs.jpca.6b08405

Korvinson, Kirill A.; Hargenrader, George N.; Stevanović, Jelena; Xie, Yun; Joseph, Jojo; Maslak, Veselin; Hadad, Christopher M.; Glusac, Ksenija D.

(Amer Chemical Soc, Washington, 2016)

TY  - BOOK
AU  - Korvinson, Kirill A.
AU  - Hargenrader, George N.
AU  - Stevanović, Jelena
AU  - Xie, Yun
AU  - Joseph, Jojo
AU  - Maslak, Veselin
AU  - Hadad, Christopher M.
AU  - Glusac, Ksenija D.
PY  - 2016
UR  - http://cherry.chem.bg.ac.rs/handle/123456789/3542
PB  - Amer Chemical Soc, Washington
T2  - Journal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th
T1  - Supplementary material for the article: Korvinson, K. A.; Hargenrader, G. N.; Stevanovic, J.; Xie, Y.; Joseph, J.; Maslak, V.; Hadad, 
C. M.; Glusac, K. D. Improved Flavin-Based Catalytic Photooxidation of Alcohols through 
Intersystem Crossing Rate Enhancement. Journal of Physical Chemistry A 2016, 120 (37), 
7294–7300. https://doi.org/10.1021/acs.jpca.6b08405
ER  - 
@book{
author = "Korvinson, Kirill A. and Hargenrader, George N. and Stevanović, Jelena and Xie, Yun and Joseph, Jojo and Maslak, Veselin and Hadad, Christopher M. and Glusac, Ksenija D.",
year = "2016",
url = "http://cherry.chem.bg.ac.rs/handle/123456789/3542",
publisher = "Amer Chemical Soc, Washington",
journal = "Journal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th",
title = "Supplementary material for the article: Korvinson, K. A.; Hargenrader, G. N.; Stevanovic, J.; Xie, Y.; Joseph, J.; Maslak, V.; Hadad, 
C. M.; Glusac, K. D. Improved Flavin-Based Catalytic Photooxidation of Alcohols through 
Intersystem Crossing Rate Enhancement. Journal of Physical Chemistry A 2016, 120 (37), 
7294–7300. https://doi.org/10.1021/acs.jpca.6b08405"
}
Korvinson, K. A., Hargenrader, G. N., Stevanović, J., Xie, Y., Joseph, J., Maslak, V., Hadad, C. M.,& Glusac, K. D. (2016). Supplementary material for the article: Korvinson, K. A.; Hargenrader, G. N.; Stevanovic, J.; Xie, Y.; Joseph, J.; Maslak, V.; Hadad, 
C. M.; Glusac, K. D. Improved Flavin-Based Catalytic Photooxidation of Alcohols through 
Intersystem Crossing Rate Enhancement. Journal of Physical Chemistry A 2016, 120 (37), 
7294–7300. https://doi.org/10.1021/acs.jpca.6b08405.
Journal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th
Amer Chemical Soc, Washington..
Korvinson KA, Hargenrader GN, Stevanović J, Xie Y, Joseph J, Maslak V, Hadad CM, Glusac KD. Supplementary material for the article: Korvinson, K. A.; Hargenrader, G. N.; Stevanovic, J.; Xie, Y.; Joseph, J.; Maslak, V.; Hadad, 
C. M.; Glusac, K. D. Improved Flavin-Based Catalytic Photooxidation of Alcohols through 
Intersystem Crossing Rate Enhancement. Journal of Physical Chemistry A 2016, 120 (37), 
7294–7300. https://doi.org/10.1021/acs.jpca.6b08405. Journal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th. 2016;
Korvinson Kirill A., Hargenrader George N., Stevanović Jelena, Xie Yun, Joseph Jojo, Maslak Veselin, Hadad Christopher M., Glusac Ksenija D., "Supplementary material for the article: Korvinson, K. A.; Hargenrader, G. N.; Stevanovic, J.; Xie, Y.; Joseph, J.; Maslak, V.; Hadad, 
C. M.; Glusac, K. D. Improved Flavin-Based Catalytic Photooxidation of Alcohols through 
Intersystem Crossing Rate Enhancement. Journal of Physical Chemistry A 2016, 120 (37), 
7294–7300. https://doi.org/10.1021/acs.jpca.6b08405" Journal of Physical Chemistry. Part A: Molecules, Spectroscopy, Kinetics, Environment and General Th (2016)

Supplementary material for the article: Mitrović, A.; Stevanović, J.; Milčić, M.; Žekić, A.; Stanković, D.; Chen, S.; Badjić, J. D.; Milić, D.; Maslak, V. Fulleropyrrolidine Molecular Dumbbells Act as Multi-Electron-Acceptor Triads. Spectroscopic, Electrochemical, Computational and Morphological Characterizations. RSC Advances 2015, 5 (107), 88241–88248. https://doi.org/10.1039/c5ra16309a

Mitrović, Aleksandra D.; Stevanović, Jelena; Milčić, Miloš K.; Zekić, Andrijana; Stanković, Dalibor; Chen, Shigui; Bađić, Jovica D.; Milić, Dragana; Maslak, Veselin

(Royal Soc Chemistry, Cambridge, 2015)

TY  - BOOK
AU  - Mitrović, Aleksandra D.
AU  - Stevanović, Jelena
AU  - Milčić, Miloš K.
AU  - Zekić, Andrijana
AU  - Stanković, Dalibor
AU  - Chen, Shigui
AU  - Bađić, Jovica D.
AU  - Milić, Dragana
AU  - Maslak, Veselin
PY  - 2015
UR  - http://cherry.chem.bg.ac.rs/handle/123456789/3369
PB  - Royal Soc Chemistry, Cambridge
T2  - RSC Advances
T1  - Supplementary material for the article: Mitrović, A.; Stevanović, J.; Milčić, M.; Žekić, A.; Stanković, D.; Chen, S.; Badjić, J. D.; Milić, D.; Maslak, V. Fulleropyrrolidine Molecular Dumbbells Act as Multi-Electron-Acceptor Triads. Spectroscopic, Electrochemical, Computational and Morphological Characterizations. RSC Advances 2015, 5 (107), 88241–88248. https://doi.org/10.1039/c5ra16309a
ER  - 
@book{
author = "Mitrović, Aleksandra D. and Stevanović, Jelena and Milčić, Miloš K. and Zekić, Andrijana and Stanković, Dalibor and Chen, Shigui and Bađić, Jovica D. and Milić, Dragana and Maslak, Veselin",
year = "2015",
url = "http://cherry.chem.bg.ac.rs/handle/123456789/3369",
publisher = "Royal Soc Chemistry, Cambridge",
journal = "RSC Advances",
title = "Supplementary material for the article: Mitrović, A.; Stevanović, J.; Milčić, M.; Žekić, A.; Stanković, D.; Chen, S.; Badjić, J. D.; Milić, D.; Maslak, V. Fulleropyrrolidine Molecular Dumbbells Act as Multi-Electron-Acceptor Triads. Spectroscopic, Electrochemical, Computational and Morphological Characterizations. RSC Advances 2015, 5 (107), 88241–88248. https://doi.org/10.1039/c5ra16309a"
}
Mitrović, A. D., Stevanović, J., Milčić, M. K., Zekić, A., Stanković, D., Chen, S., Bađić, J. D., Milić, D.,& Maslak, V. (2015). Supplementary material for the article: Mitrović, A.; Stevanović, J.; Milčić, M.; Žekić, A.; Stanković, D.; Chen, S.; Badjić, J. D.; Milić, D.; Maslak, V. Fulleropyrrolidine Molecular Dumbbells Act as Multi-Electron-Acceptor Triads. Spectroscopic, Electrochemical, Computational and Morphological Characterizations. RSC Advances 2015, 5 (107), 88241–88248. https://doi.org/10.1039/c5ra16309a.
RSC Advances
Royal Soc Chemistry, Cambridge..
Mitrović AD, Stevanović J, Milčić MK, Zekić A, Stanković D, Chen S, Bađić JD, Milić D, Maslak V. Supplementary material for the article: Mitrović, A.; Stevanović, J.; Milčić, M.; Žekić, A.; Stanković, D.; Chen, S.; Badjić, J. D.; Milić, D.; Maslak, V. Fulleropyrrolidine Molecular Dumbbells Act as Multi-Electron-Acceptor Triads. Spectroscopic, Electrochemical, Computational and Morphological Characterizations. RSC Advances 2015, 5 (107), 88241–88248. https://doi.org/10.1039/c5ra16309a. RSC Advances. 2015;
Mitrović Aleksandra D., Stevanović Jelena, Milčić Miloš K., Zekić Andrijana, Stanković Dalibor, Chen Shigui, Bađić Jovica D., Milić Dragana, Maslak Veselin, "Supplementary material for the article: Mitrović, A.; Stevanović, J.; Milčić, M.; Žekić, A.; Stanković, D.; Chen, S.; Badjić, J. D.; Milić, D.; Maslak, V. Fulleropyrrolidine Molecular Dumbbells Act as Multi-Electron-Acceptor Triads. Spectroscopic, Electrochemical, Computational and Morphological Characterizations. RSC Advances 2015, 5 (107), 88241–88248. https://doi.org/10.1039/c5ra16309a" RSC Advances (2015)

Fulleropyrrolidine molecular dumbbells act as multi-electron-acceptor triads. Spectroscopic, electrochemical, computational and morphological characterizations

Mitrović, Aleksandra D.; Stevanović, Jelena; Milčić, Miloš K.; Zekić, Andrijana; Stanković, Dalibor; Chen, Shigui; Bađić, Jovica D.; Milić, Dragana; Maslak, Veselin

(Royal Soc Chemistry, Cambridge, 2015)

TY  - JOUR
AU  - Mitrović, Aleksandra D.
AU  - Stevanović, Jelena
AU  - Milčić, Miloš K.
AU  - Zekić, Andrijana
AU  - Stanković, Dalibor
AU  - Chen, Shigui
AU  - Bađić, Jovica D.
AU  - Milić, Dragana
AU  - Maslak, Veselin
PY  - 2015
UR  - http://cherry.chem.bg.ac.rs/handle/123456789/1984
AB  - We synthesized three dumbbell-like compounds 2a-c, each containing two C-60 groups at the periphery and pyromellitic diimide (PMDI) in the middle, and examined their electronic as well as assembly characteristics with both experimental and computational methods. Cyclic voltammetry (CV) measurements revealed that each of three electron-accepting (AAA) triads could accommodate up to eight electrons. Computational studies (density functional theory, DFT) of 2a-c at PBEPBE/6-311G(d, p) level of theory, with B3LYP/6-31G(d) optimized geometries, revealed that HOMO-LUMO energy gaps are similar to those of the model compound [6,6]-phenyl-C-61-butyric acid methyl ester (PCBM). Compounds 2a-c were also found to assemble into vesicles and nanoparticles on the copper grid (100-300 nm, TEM), while giving more sizeable aggregates after a deposition on the glass (SEM,  gt  5 mm). Understanding the packing of 2a-c on various solid substrates, as well as the assembly characteristics in general, is important for tuning the properties and fabrication of electronic/optical devices. On the basis of the results of conformational analysis (MM and DFT calculations), we deduced that different alkyl spacers in 2a-c ought to play a role in pi-pi interactions between the aromatic components of the triad to guide the packing and therefore morphology of the material.
PB  - Royal Soc Chemistry, Cambridge
T2  - RSC Advances
T1  - Fulleropyrrolidine molecular dumbbells act as multi-electron-acceptor triads. Spectroscopic, electrochemical, computational and morphological characterizations
VL  - 5
IS  - 107
SP  - 88241
EP  - 88248
DO  - 10.1039/c5ra16309a
ER  - 
@article{
author = "Mitrović, Aleksandra D. and Stevanović, Jelena and Milčić, Miloš K. and Zekić, Andrijana and Stanković, Dalibor and Chen, Shigui and Bađić, Jovica D. and Milić, Dragana and Maslak, Veselin",
year = "2015",
url = "http://cherry.chem.bg.ac.rs/handle/123456789/1984",
abstract = "We synthesized three dumbbell-like compounds 2a-c, each containing two C-60 groups at the periphery and pyromellitic diimide (PMDI) in the middle, and examined their electronic as well as assembly characteristics with both experimental and computational methods. Cyclic voltammetry (CV) measurements revealed that each of three electron-accepting (AAA) triads could accommodate up to eight electrons. Computational studies (density functional theory, DFT) of 2a-c at PBEPBE/6-311G(d, p) level of theory, with B3LYP/6-31G(d) optimized geometries, revealed that HOMO-LUMO energy gaps are similar to those of the model compound [6,6]-phenyl-C-61-butyric acid methyl ester (PCBM). Compounds 2a-c were also found to assemble into vesicles and nanoparticles on the copper grid (100-300 nm, TEM), while giving more sizeable aggregates after a deposition on the glass (SEM,  gt  5 mm). Understanding the packing of 2a-c on various solid substrates, as well as the assembly characteristics in general, is important for tuning the properties and fabrication of electronic/optical devices. On the basis of the results of conformational analysis (MM and DFT calculations), we deduced that different alkyl spacers in 2a-c ought to play a role in pi-pi interactions between the aromatic components of the triad to guide the packing and therefore morphology of the material.",
publisher = "Royal Soc Chemistry, Cambridge",
journal = "RSC Advances",
title = "Fulleropyrrolidine molecular dumbbells act as multi-electron-acceptor triads. Spectroscopic, electrochemical, computational and morphological characterizations",
volume = "5",
number = "107",
pages = "88241-88248",
doi = "10.1039/c5ra16309a"
}
Mitrović, A. D., Stevanović, J., Milčić, M. K., Zekić, A., Stanković, D., Chen, S., Bađić, J. D., Milić, D.,& Maslak, V. (2015). Fulleropyrrolidine molecular dumbbells act as multi-electron-acceptor triads. Spectroscopic, electrochemical, computational and morphological characterizations.
RSC Advances
Royal Soc Chemistry, Cambridge., 5(107), 88241-88248.
https://doi.org/10.1039/c5ra16309a
Mitrović AD, Stevanović J, Milčić MK, Zekić A, Stanković D, Chen S, Bađić JD, Milić D, Maslak V. Fulleropyrrolidine molecular dumbbells act as multi-electron-acceptor triads. Spectroscopic, electrochemical, computational and morphological characterizations. RSC Advances. 2015;5(107):88241-88248
Mitrović Aleksandra D., Stevanović Jelena, Milčić Miloš K., Zekić Andrijana, Stanković Dalibor, Chen Shigui, Bađić Jovica D., Milić Dragana, Maslak Veselin, "Fulleropyrrolidine molecular dumbbells act as multi-electron-acceptor triads. Spectroscopic, electrochemical, computational and morphological characterizations" RSC Advances, 5, no. 107 (2015):88241-88248,
https://doi.org/10.1039/c5ra16309a .
2
2
2