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Journal of Molecular Structure: THEOCHEM

Volumn 593, Issue 1-3, 2002, Pages 93-100

A density functional theory study on the structure and properties of the tert-butyl substituted phthalocyanines

(3) Gong, Xue Dong a Xiao, He Ming a Tian, He b

a NANJING UNIVERSITY OF SCIENCE AND TECHNOLOGY (China)

b EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (China)

Author keywords

Density functional theory; Geometry; Infrared spectrum; Tert butyl substituted Pc; Thermodynamic functions; UV Vis spectrum

Indexed keywords

PHTHALOCYANINE DERIVATIVE;

ARTICLE; ATOM; CALCULATION; CHEMICAL STRUCTURE; DENSITY; ENERGY; ENTHALPY; GEOMETRY; INFRARED SPECTROSCOPY; ISOMER; PARAMETER; STRUCTURE ANALYSIS; THEORY; ULTRAVIOLET SPECTROSCOPY; VIBRATION;

EID: 0037183784 PISSN: 01661280 EISSN: None Source Type: Journal
DOI: 10.1016/S0166-1280(02)00302-0 Document Type: Article

Times cited : (22)

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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.