MONTE-CARLO STUDY OF THE AQUEOUS HYDRATION OF FORMAMIDE AT 25-DEGREES-C

被引:56
作者
MARCHESE, FT [1 ]
MEHROTRA, PK [1 ]
BEVERIDGE, DL [1 ]
机构
[1] CUNY HUNTER COLL,DEPT CHEM,NEW YORK,NY 10021
关键词
D O I
10.1021/j150667a048
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
引用
收藏
页码:5692 / 5702
页数:11
相关论文
共 45 条
[11]  
DIETZ W, 1982, Z NATURFORSCH A, V37, P1038
[12]   A NON-EMPIRICAL STUDY OF HYDROGEN BONDING IN DIMER OF FORMAMIDE [J].
DREYFUS, M ;
MAIGRET, B ;
PULLMAN, A .
THEORETICA CHIMICA ACTA, 1970, 17 (02) :109-&
[13]   THE EFFECT OF SOLVENT ON THE INTERNAL-ROTATION OF FORMAMIDE - A CNDO/2-SOLVATON METHOD STUDY [J].
DUBEN, AJ ;
MIERTUS, S .
THEORETICA CHIMICA ACTA, 1981, 60 (04) :327-337
[14]   MONTE-CARLO SIMULATION OF WATER BEHAVIOR AROUND THE DIPEPTIDE N-ACETYLALANYL-N-METHYLAMIDE [J].
HAGLER, AT ;
OSGUTHORPE, DJ ;
ROBSON, B .
SCIENCE, 1980, 208 (4444) :599-601
[15]  
HEINZINGER K, 1976, Z NATURFORSCH A, V31, P463
[16]   NMR STUDIES OF STRUCTURE OF AQUEOUS AMIDE SOLUTIONS [J].
HINTON, JF ;
LADNER, KH .
JOURNAL OF MAGNETIC RESONANCE, 1972, 6 (04) :586-&
[17]   ABINITIO INVESTIGATION OF (FORMAMIDE)N AND FORMAMIDE-(H2O)N SYSTEMS - TENTATIVE MODELS FOR LIQUID-STATE AND DILUTE AQUEOUS-SOLUTION [J].
HINTON, JF ;
HARPOOL, RD .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1977, 99 (02) :349-353
[18]   MOLECULAR-STRUCTURE AND INTERNAL MOTION OF FORMAMIDE FROM MICROWAVE-SPECTRUM [J].
HIROTA, E ;
SUGISAKI, R ;
NIELSEN, CJ ;
SORENSEN, GO .
JOURNAL OF MOLECULAR SPECTROSCOPY, 1974, 49 (02) :251-267
[19]  
HOFFMANN HJ, 1979, INT J QUANTUM CHEM, V16, P379
[20]   AMIDE-WATER HYDROGEN-BONDING [J].
JOHANSSON, A ;
KOLLMAN, PA .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1972, 94 (17) :6196-+