Cation-pi interaction with transition-metal complex as cation
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1999
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A novel type of cation-pi interaction, where a transition-metal complex cation interacts with a pi-system, is predicted here. The theoretical calculations on the [Co(NH3)(6)](3+)-C6H6 system presented demonstrate that a transition-metal complex cation can interact strongly with pi-systems. The bonding energy obtained with the B3LYP method is 31.34 kcal/mol. In the most stable structure, three NH3 groups from [Co(NH3)(6)](3+) interact with the pi-system of benzene. (C) 1999 Elsevier Science B.V. All rights reserved.
Izvor:
Chemical Physics Letters, 1999, 311, 1-2, 77-80Izdavač:
- Elsevier Science Bv, Amsterdam
DOI: 10.1016/S0009-2614(99)00805-2
ISSN: 0009-2614
WoS: 000083157900012
Scopus: 2-s2.0-0002101041
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Hemijski fakultet / Faculty of ChemistryTY - JOUR AU - Zarić, Snežana D. PY - 1999 UR - https://cherry.chem.bg.ac.rs/handle/123456789/423 AB - A novel type of cation-pi interaction, where a transition-metal complex cation interacts with a pi-system, is predicted here. The theoretical calculations on the [Co(NH3)(6)](3+)-C6H6 system presented demonstrate that a transition-metal complex cation can interact strongly with pi-systems. The bonding energy obtained with the B3LYP method is 31.34 kcal/mol. In the most stable structure, three NH3 groups from [Co(NH3)(6)](3+) interact with the pi-system of benzene. (C) 1999 Elsevier Science B.V. All rights reserved. PB - Elsevier Science Bv, Amsterdam T2 - Chemical Physics Letters T1 - Cation-pi interaction with transition-metal complex as cation VL - 311 IS - 1-2 SP - 77 EP - 80 DO - 10.1016/S0009-2614(99)00805-2 ER -
@article{ author = "Zarić, Snežana D.", year = "1999", abstract = "A novel type of cation-pi interaction, where a transition-metal complex cation interacts with a pi-system, is predicted here. The theoretical calculations on the [Co(NH3)(6)](3+)-C6H6 system presented demonstrate that a transition-metal complex cation can interact strongly with pi-systems. The bonding energy obtained with the B3LYP method is 31.34 kcal/mol. In the most stable structure, three NH3 groups from [Co(NH3)(6)](3+) interact with the pi-system of benzene. (C) 1999 Elsevier Science B.V. All rights reserved.", publisher = "Elsevier Science Bv, Amsterdam", journal = "Chemical Physics Letters", title = "Cation-pi interaction with transition-metal complex as cation", volume = "311", number = "1-2", pages = "77-80", doi = "10.1016/S0009-2614(99)00805-2" }
Zarić, S. D.. (1999). Cation-pi interaction with transition-metal complex as cation. in Chemical Physics Letters Elsevier Science Bv, Amsterdam., 311(1-2), 77-80. https://doi.org/10.1016/S0009-2614(99)00805-2
Zarić SD. Cation-pi interaction with transition-metal complex as cation. in Chemical Physics Letters. 1999;311(1-2):77-80. doi:10.1016/S0009-2614(99)00805-2 .
Zarić, Snežana D., "Cation-pi interaction with transition-metal complex as cation" in Chemical Physics Letters, 311, no. 1-2 (1999):77-80, https://doi.org/10.1016/S0009-2614(99)00805-2 . .