Sur une definition OM de la dureté moléculaire; quelques applications

Autor:	Mario Giambiagi, Myriam Segre de Giambiagi
Rok vydání:	1993
Předmět:	Chain length Homologous series chemistry.chemical_compound chemistry Hydrogen bond Polarizability Physical chemistry Physics::Chemical Physics Physical and Theoretical Chemistry Condensed Matter Physics Biochemistry
Zdroj:	Journal of Molecular Structure: THEOCHEM. 288:273-282
ISSN:	0166-1280
DOI:	10.1016/0166-1280(93)87058-l
Popis:	The hypotheses involved in an MO definition of hardness/softness, previously introduced, are discussed. Hardness of the homologous series of alcohols, aldehydes and acid derivatives of saturated hydrocarbons is calculated; it decreases monotonically with the chain length. An analytical expression relating softness with the experimental molecular polarizability is found.
Databáze:	OpenAIRE
Externí odkaz:	https://explore.openaire.eu/search/publication?articleId=doi_________::7ba881a875ce09852f78e3b1b9c2e082 https://doi.org/10.1016/0166-1280(93)87058-l Zobrazit plný text záznamu