Zobrazeno 1 - 2
of 2
pro vyhledávání: '"Anzhelika I. Slabko"'
Publikováno v:
Chemical Physics Letters. 556:18-22
Analysis of geometric parameters of butadiene and acrolein reveals the contradiction between the Csp2–Csp2 bond length in acrolein and classical concept of conjugation degree in the polarized molecules. In this Letter the reasons of this contradict
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::459dd24323c6c79710e9628c2ce3f656
https://doi.org/10.1016/j.cplett.2012.11.032
https://doi.org/10.1016/j.cplett.2012.11.032
Autor:
Zdzisław Latajka, Svitlana V. Shishkina, Anzhelika I. Slabko, Slawomir Berski, Oleg V. Shishkin
Publikováno v:
The Journal of Chemical Physics. 139:124308
Quantum-chemical calculations of the H-O-N=O molecule in the equilibrium and transition states and the complexes of the HONO with BH3, study of the intramolecular interactions using NBO theory, and investigation of the electron distribution on the ba
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::10c344aa0859f19d5cfdfe7cf973b775
https://doi.org/10.1063/1.4821999
https://doi.org/10.1063/1.4821999