ELECTRONIC STATES OF DIOXYGEN HEME COMPLEX REVEALED FROM ABINITIO LCAO-SCF-MO CALCULATIONS

被引:18
作者
NOZAWA, T
HATANO, M
NAGASHIMA, U
OBARA, S
KASHIWAGI, H
机构
[1] HOKKAIDO UNIV,FAC SCI,DEPT CHEM,KITA KU,SAPPORO,HOKKAIDO 060,JAPAN
[2] INST MOLEC SCI,OKAZAKI,AICHI 444,JAPAN
关键词
D O I
10.1246/bcsj.56.1721
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:1721 / 1727
页数:7
相关论文
共 50 条
[1]   INFRARED-SPECTRA OF 16O3 AND 18O3 - DARLING AND DENNISON RESONANCE AND ANHARMONIC POTENTIAL FUNCTION OF OZONE [J].
BARBE, A ;
SECROUN, C ;
JOUVE, P .
JOURNAL OF MOLECULAR SPECTROSCOPY, 1974, 49 (02) :171-182
[2]   ELUCIDATION OF MODE OF BINDING OF OXYGEN TO IRON IN OXYHEMOGLOBIN BY INFRARED SPECTROSCOPY [J].
BARLOW, CH ;
MAXWELL, JC ;
WALLACE, WJ ;
CAUGHEY, WS .
BIOCHEMICAL AND BIOPHYSICAL RESEARCH COMMUNICATIONS, 1973, 55 (01) :91-95
[3]   VIBRATION-ROTATION BANDS OF AMMONIA .2. THE MOLECULAR DIMENSIONS AND HARMONIC FREQUENCIES OF AMMONIA AND DEUTERATED AMMONIA [J].
BENEDICT, WS ;
PLYLER, EK .
CANADIAN JOURNAL OF PHYSICS, 1957, 35 (10) :1235-1241
[4]   BINDING OF OXYGEN AND CARBON-MONOXIDE TO HEMOGLOBIN - ANALYSIS OF THE GROUND AND EXCITED-STATES [J].
CASE, DA ;
HUYNH, BH ;
KARPLUS, M .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1979, 101 (16) :4433-4453
[5]   ROOM-TEMPERATURE MAGNETIC-PROPERTIES OF OXYHEMOGLOBIN AND CARBONMONOXY-HEMOGLOBIN [J].
CERDONIO, M ;
CONGIUCASTELLANO, A ;
CALABRESE, L ;
MORANTE, S ;
PISPISA, B ;
VITALE, S .
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, 1978, 75 (10) :4916-4919
[6]   MAGNETIC-PROPERTIES OF OXYHEMOGLOBIN [J].
CERDONIO, M ;
CONGIUCASTELLANO, A ;
MOGNO, F ;
PISPISA, B ;
ROMANI, GL ;
VITALE, S .
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA, 1977, 74 (02) :398-400
[7]  
COLLMAN J P, 1974, Proceedings of the National Academy of Sciences of the United States of America, V71, P1326, DOI 10.1073/pnas.71.4.1326
[8]   PICKET-FENCE PORPHYRINS - SYNTHETIC MODELS FOR OXYGEN BINDING HEMOPROTEINS [J].
COLLMAN, JP ;
GAGNE, RR ;
REED, CA ;
HALBERT, TR ;
LANG, G ;
ROBINSON, WT .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (06) :1427-1439
[9]  
COLLMAN JP, 1976, P NATL ACAD SCI USA, V73, P333
[10]   The magnetic properties of intermediates in the reactions of hemoglobin [J].
Coryell, CD ;
Pauling, L ;
Dodson, RW .
JOURNAL OF PHYSICAL CHEMISTRY, 1939, 43 (07) :825-839