A quantitative topological descriptor for linear co-oligomer fusion

A quantitative topological descriptor for linear co-oligomer fusion Научная публикация

Журнал

Chemical Communications
ISSN: 1359-7345

Вых. Данные

Год: 2018, Том: 54, Номер: 52, Страницы: 7235-7238 Страниц : 4 DOI: 10.1039/c8cc03156h

Авторы

Koskin Igor P. ^1,2 , Mostovich Evgeny A. ^1,2 , Benassi Enrico ^2,3 , Kazantsev Maxim S. ^1,2

Организации

1	(Данные Web of science) NN Vorozhtsov Novosibirsk Inst Organ Chem, Lavrentieva 9, Novosibirsk 630090, Russia
2	(Данные Web of science) Novosibirsk State Univ, Pirogova 2, Novosibirsk 630090, Russia
3	(Данные Web of science) Nazarbayev Univ, Sch Sci & Technol, 53 Kabanbay Batyr Ave, Astana 010000, Kazakhstan

A purely topological descriptor for the quantitative classification of fully or partially fused linear quasi-one dimensional centre-symmetric molecules is proposed. The index also makes it possible to quantitatively correlate optoelectronic properties with the molecular topology without involving an explicit calculation of the molecular electronic structure.

Koskin I.P. , Mostovich E.A. , Benassi E. , Kazantsev M.S.
A quantitative topological descriptor for linear co-oligomer fusion
Chemical Communications. 2018. V.54. N52. P.7235-7238. DOI: 10.1039/c8cc03156h WOS Scopus РИНЦ

Web of science	WOS:000436290100030
Scopus	2-s2.0-85049126581
РИНЦ	35742852
OpenAlex	W2806442695