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Open access
volume 33 issue 1 pages 41-44

Electron density topology in CaII–CuII alanine hydroximate metallacrowns: crystal invariom vs DFT calculation

Publication typeJournal Article
Publication date2023-01-01
scimago Q3
wos Q3
SJR0.305
CiteScore3.0
Impact factor1.7
ISSN09599436, 1364551X
General Chemistry
Abstract
The first insight into the nature of intramolecular interactions in the CaII–CuII alanine hydroximate metallacrowns is provided on the basis of the invariom refinement and DFT calculations.
Found 
Found 

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GOST |
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GOST Copy
Rumyantcev R. V. et al. Electron density topology in CaII–CuII alanine hydroximate metallacrowns: crystal invariom vs DFT calculation // Mendeleev Communications. 2023. Vol. 33. No. 1. pp. 41-44.
GOST all authors (up to 50) Copy
Rumyantcev R. V., Yu. Zhigulin G., Zabrodina G. S., Katkova M. A., Yu. Ketkov S., Fukin G. K. Electron density topology in CaII–CuII alanine hydroximate metallacrowns: crystal invariom vs DFT calculation // Mendeleev Communications. 2023. Vol. 33. No. 1. pp. 41-44.
RIS |
Cite this
RIS Copy
TY - JOUR
DO - 10.1016/j.mencom.2023.01.012
UR - https://doi.org/10.1016/j.mencom.2023.01.012
TI - Electron density topology in CaII–CuII alanine hydroximate metallacrowns: crystal invariom vs DFT calculation
T2 - Mendeleev Communications
AU - Rumyantcev, Roman V.
AU - Yu. Zhigulin, Grigory
AU - Zabrodina, Galina S.
AU - Katkova, Marina A.
AU - Yu. Ketkov, Sergey
AU - Fukin, Georgy K.
PY - 2023
DA - 2023/01/01
PB - OOO Zhurnal "Mendeleevskie Soobshcheniya"
SP - 41-44
IS - 1
VL - 33
SN - 0959-9436
SN - 1364-551X
ER -
BibTex |
Cite this
BibTex (up to 50 authors) Copy
@article{2023_Rumyantcev,
author = {Roman V. Rumyantcev and Grigory Yu. Zhigulin and Galina S. Zabrodina and Marina A. Katkova and Sergey Yu. Ketkov and Georgy K. Fukin},
title = {Electron density topology in CaII–CuII alanine hydroximate metallacrowns: crystal invariom vs DFT calculation},
journal = {Mendeleev Communications},
year = {2023},
volume = {33},
publisher = {OOO Zhurnal "Mendeleevskie Soobshcheniya"},
month = {jan},
url = {https://doi.org/10.1016/j.mencom.2023.01.012},
number = {1},
pages = {41--44},
doi = {10.1016/j.mencom.2023.01.012}
}
MLA
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MLA Copy
Rumyantcev, Roman V., et al. “Electron density topology in CaII–CuII alanine hydroximate metallacrowns: crystal invariom vs DFT calculation.” Mendeleev Communications, vol. 33, no. 1, Jan. 2023, pp. 41-44. https://doi.org/10.1016/j.mencom.2023.01.012.