MOLECULAR-ORBITAL DESCRIPTIONS OF BONDING IN BIS(AMINO)DIBORANE(4) AND (AMINO)VINYLBORANE AS THEORETICAL MODELS FOR PHOTOCHEMICAL REACTIVITY

被引:9
作者
URIARTE, AK [1 ]
HANCOCK, KG [1 ]
机构
[1] UNIV CALIF,DEPT CHEM,DAVIS,CA 95616
关键词
D O I
10.1021/ic50124a044
中图分类号
O61 [无机化学];
学科分类号
070301 ; 081704 ;
摘要
引用
收藏
页码:1428 / 1431
页数:4
相关论文
共 31 条
[1]   ELECTRONIC STRUCTURE OF AMINOBORANE - A COMPARISON BETWEEN NONEMPIRICAL AND SEMIEMPIRICAL THEORETICAL METHODS [J].
ARMSTRONG, DR ;
DUKE, BJ ;
PERKINS, PG .
JOURNAL OF THE CHEMICAL SOCIETY A -INORGANIC PHYSICAL THEORETICAL, 1969, (17) :2566-+
[2]   APPROXIMATE HARTREE-FOCK WAVEFUNCTIONS ONE-ELECTRON PROPERTIES AND ELECTRONIC STRUCTURE OF WATER MOLECULE [J].
AUNG, S ;
PITZER, RM ;
CHAN, SI .
JOURNAL OF CHEMICAL PHYSICS, 1968, 49 (05) :2071-+
[3]   MOLECULAR ORBITAL CALCULATIONS FOR CONJUGATED MOLECULES CONTAINING BORON AND NITROGEN [J].
BAIRD, NC ;
WHITEHEAD, MA .
CANADIAN JOURNAL OF CHEMISTRY-BACK YEAR, 1967, 45 (18) :2059-+
[4]   VALENCE ORBITAL IONIZATION POTENTIALS FROM ATOMIC SPECTRAL DATA [J].
BASCH, H ;
VISTE, A ;
GRAY, HB .
THEORETICA CHIMICA ACTA, 1965, 3 (05) :458-&
[5]   CRYSTALLOGRAPHIC STUDIES OF BORON-NITROGEN BOND IN AMINOBORANES .2. CRYSTAL STRUCTURE OF (DIMETHYLAMINO)DIMETHYLBORANE AT -95 DEGREES C [J].
BULLEN, GJ ;
CLARK, NH .
JOURNAL OF THE CHEMICAL SOCIETY A -INORGANIC PHYSICAL THEORETICAL, 1970, (06) :992-&
[6]   SEMIEMPIRICAL MOLECULAR ORBITAL CALCULATIONS .I. ELECTRONIC STRUCTURE OF H2O AND H2S [J].
CARROLL, DG ;
ARMSTRONG, AT ;
MCGLYNN, SP .
JOURNAL OF CHEMICAL PHYSICS, 1966, 44 (05) :1865-+
[7]   AN INVESTIGATION OF BORON-NITROGEN BONDS IN SOME AMINOBORANES [J].
CHAKRABA.MR ;
THOMPSON, CC ;
BREY, WS .
INORGANIC CHEMISTRY, 1967, 6 (03) :518-&
[8]   ATOMIC SCREENING CONSTANTS FROM SCF FUNCTIONS [J].
CLEMENTI, E ;
RAIMONDI, DL .
JOURNAL OF CHEMICAL PHYSICS, 1963, 38 (11) :2686-&
[9]  
CLIPPARD FB, 1970, INORG CHEM, V9, P2439
[10]   ITERATIVE EXTENDED HUCKEL METHOD (IEHM) [J].
DUKE, BJ .
THEORETICA CHIMICA ACTA, 1968, 9 (03) :260-&