A first-principles quantum chemical analysis of the factors controlling ruffling deformations of porphyrins: Insights from the molecular structures and potential energy surfaces of silicon, phosphorus, germanium, and arsenic porphyrins and of a peroxidase compound I model

Journal of the American Chemical Society

Volumn 121, Issue 51, 1999, Pages 12154-12160

  Vangberg, Torgil ^a   Ghosh, Abhik ^a  

^a UNIVERSITY OF TROMSØ   (Norway)

Author keywords

[No Author keywords available]

Indexed keywords

ARSENIC; GERMANIUM; HEMATIN; MACROCYCLIC COMPOUND; PEROXIDASE; PHENYL GROUP; PHOSPHORUS; PORPHYRIN; PYRIDINE DERIVATIVE; SILICON;

ARTICLE; CHEMICAL ANALYSIS; CHEMICAL STRUCTURE; COMPLEX FORMATION; CONFORMATION; DENSITY; ENERGY TRANSFER; GEOMETRY; MOLECULAR MODEL; QUANTUM CHEMISTRY; THEORY;

EID: 0033616107     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja992457i     Document Type: Article

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