Molecular orbital quantities of conjugated ketenes and influence of structural variations on their electronic features

Autor:	Fumio Miyake, Kaoru Kamiya, Takachiyo Okuda, Masayuki Kuzuya
Rok vydání:	1982
Předmět:	Valence (chemistry) Allene Organic Chemistry Ketene Conjugated system Photochemistry Biochemistry Cycloaddition CNDO/2 chemistry.chemical_compound chemistry Drug Discovery Molecule Molecular orbital
Zdroj:	Tetrahedron Letters. 23:2593-2596
ISSN:	0040-4039
DOI:	10.1016/s0040-4039(00)87404-3
Popis:	MO quantities by CNDO/2 method on several valence isomeric ketenes and structurally corresponding allene molecules were calculated to evaluate the influence of structural feature on magnitude of back-donation of oxygen n-electrons in ketene, and to rationalize an unusual cycloaddition involved in diphenyl ketene.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::4842b72993ad955c5f02400ff3bb88e1 https://doi.org/10.1016/s0040-4039(00)87404-3 Zobrazit plný text záznamu