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Inorganica Chimica Acta

Volumn 297, Issue 1-2, 2000, Pages 11-17

Role of the axial ligand in heme-CO backbonding; DFT analysis of vibrational data

(4) Vogel, Kathleen M a Kozlowski, Pawel M a Zgierski, Marek Z b Spiro, Thomas G a

a PRINCETON UNIVERSITY (United States)

b NATIONAL RESEARCH COUNCIL CANADA (Canada)

Author keywords

Backbonding; Carbon monoxide; Density functional theory study; Heme

Indexed keywords

BOND LENGTH; CARBON MONOXIDE; DENSITY FUNCTIONAL THEORY; LIGANDS; PORPHYRINS; PROTEINS;

BACK-BONDING; COORDINATE COMPLEXES; DENSITY FUNCTIONAL THEORY STUDIES; ELECTRONWITHDRAWING; EXPERIMENTAL VALUES; HEME; NON-LOCAL DENSITY FUNCTIONAL THEORIES; RESONANCE RAMAN SPECTRA;

IRON COMPOUNDS;

CARBON MONOXIDE; HEMOPROTEIN; IMIDAZOLE; IRON COMPLEX; PORPHYRIN DERIVATIVE; PYRIDINE;

ARTICLE; CHEMICAL BOND; LIGAND BINDING; RAMAN SPECTROMETRY; VIBRATION; X RAY CRYSTALLOGRAPHY;

EID: 0033806397 PISSN: 00201693 EISSN: None Source Type: Journal
DOI: 10.1016/S0020-1693(99)00253-4 Document Type: Article

Times cited : (101)

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