Small-ring cyclic cumulenes: theoretical studies of the structure and barrier to inversion in cyclic allenes

Autor:	Richard P. Johnson, Richard O. Angus, Michael W. I. Schmidt
Rok vydání:	1985
Předmět:	chemistry.chemical_compound Colloid and Surface Chemistry Bicyclic molecule Inversion barrier Computational chemistry Chemistry Cumulene General Chemistry Ring (chemistry) Biochemistry Inversion (discrete mathematics) Catalysis
Zdroj:	Journal of the American Chemical Society. 107:532-537
ISSN:	1520-5126 0002-7863
Popis:	Description des resultats des calculs ab initio SCF, MCSCF, et Moller-Plesset sur le cyclopentadiene-1,2 et le cyclohexadiene-1,2. Calculs semi-empiriques MNDO sur des allenes cycliques (avec 4 a 9 chainons) et sur le bicyclo [3.2.1] octatriene-2,3,6
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::97316f6046ae032f407330fd20149013 https://doi.org/10.1021/ja00289a002 Zobrazit plný text záznamu