Geometry and electronic structure of metal free porphyrazine, phthalocyanine and naphthalocyanine as well as their magnesium complexes

Journal of Molecular Structure: THEOCHEM

Volumn 673, Issue 1-3, 2004, Pages 103-108

  Zhang, Xianxi ^a   Zhang, Yuexing ^a   Jiang, Jianzhuang ^a  

^a SHANDONG UNIVERSITY   (China)

Author keywords

Density functional calculations; Naphthalocyanine; Phthalocyanine; Porphyrazine; Substituent effect

Indexed keywords

MAGNESIUM DERIVATIVE; METAL; NAPHTHALENE DERIVATIVE; NAPHTHALOCYANINE; PHTHALOCYANINE; PORPHYRAZINE; PORPHYRIN DERIVATIVE; UNCLASSIFIED DRUG;

ARTICLE; ATOM; CHEMICAL STRUCTURE; COMPLEX FORMATION; DENSITY FUNCTIONAL THEORY; GEOMETRY; MOLECULE; THEORETICAL MODEL;

EID: 1442323985     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2003.12.004     Document Type: Article

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