NMR, IR/Raman, and structural properties in HNO and RNO (R = alkyl and aryl) metalloporphyrins with implication for the HNO-myoglobin complex

Journal of the American Chemical Society

Volumn 132, Issue 5, 2010, Pages 1583-1591

  Ling, Yan ^a   Mills, Christopher ^a   Weber, Rebecca ^a   Yang, Liu ^a   Zhang, Yong ^a  

^a The University of Southern Mississippi   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

ANTIBONDING; CORRELATION COEFFICIENT; DENSITY FUNCTIONAL THEORY METHODS; ELECTRON POPULATION; ENHANCED STABILITY; GENERAL TRENDS; HEME COMPLEXES; HEME PROTEINS; HYDROGEN BONDINGS; HYDROGEN-BOND EFFECT; LOCAL EFFECTS; METABOLIC INTERMEDIATES; METALLOPORPHYRINS; NMR CHEMICAL SHIFTS; ORBITALS; QUANTITATIVE STRUCTURES; QUANTUM CHEMICAL INVESTIGATION; SPECTROSCOPIC CHARACTERIZATION; SPECTROSCOPIC DATA; SPECTROSCOPIC PROPERTY; STRUCTURAL INVESTIGATION; VIBRATIONAL FREQUENCIES;

ALKYLATION; HEMOGLOBIN; HYDROGEN; HYDROGEN BONDS; METAL COMPLEXES; NUCLEAR MAGNETIC RESONANCE; PORPHYRINS; SULFUR COMPOUNDS; SYSTEM STABILITY;

DENSITY FUNCTIONAL THEORY;

HEMOPROTEIN; IRON COMPLEX; METAL COMPLEX; METALLOPORPHYRIN; MYOGLOBIN; NITRIC OXIDE; NITROSYL HYDRIDE; NITROXYL HYDRIDE; UNCLASSIFIED DRUG;

ARTICLE; COMPLEX FORMATION; DENSITY FUNCTIONAL THEORY; ELECTRON; GEOMETRY; INFRARED SPECTROSCOPY; MOLECULAR DYNAMICS; NITROGEN NUCLEAR MAGNETIC RESONANCE; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PROTEIN STRUCTURE; PROTON NUCLEAR MAGNETIC RESONANCE; QUANTITATIVE STRUCTURE ACTIVITY RELATION; QUANTUM CHEMISTRY; VIBRATION;

ALKYLATION; HEME; MODELS, MOLECULAR; MYOGLOBIN; NITROGEN OXIDES; NUCLEAR MAGNETIC RESONANCE, BIOMOLECULAR; QUANTUM THEORY; SPECTROPHOTOMETRY, INFRARED; SPECTRUM ANALYSIS, RAMAN;

EID: 76149132988     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja907342s     Document Type: Article

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