THEORETICAL OBSERVATIONS ON STRUCTURAL CONSEQUENCES OF COOPERATIVITY IN H=O HYDROGEN-BONDING

被引:80
作者
TSE, YC [1 ]
NEWTON, MD [1 ]
机构
[1] BROOKHAVEN NATL LAB,DEPT CHEM,UPTON,NY 11973
关键词
D O I
10.1021/ja00444a051
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
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页码:611 / 613
页数:3
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共 34 条
[1]   SIMPLE MODEL OF HYDROGEN-BONDING [J].
ALLEN, LC .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (24) :6921-6940
[2]   ACCURATE X-RAY-DIFFRACTION ANALYSIS OF FIBROUS POLYSACCHARIDES CONTAINING PYRANOSE RINGS .1. LINKED-ATOM APPROACH [J].
ARNOTT, S ;
SCOTT, WE .
JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2, 1972, (03) :324-&
[3]   FURTHER REFINEMENT OF STRUCTURE OF SUCROSE BASED ON NEUTRON-DIFFRACTION DATA [J].
BROWN, GM ;
LEVY, HA .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1973, B 29 (APR15) :790-797
[4]   THEORY OF MOLECULAR INTERACTIONS .1. MOLECULAR ORBITAL STUDIES OF WATER POLYMERS USING A MINIMAL SLATER-TYPE BASIS [J].
DELBENE, J ;
POPLE, JA .
JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (09) :4858-+
[6]   MOLECULAR-ORBITAL THEORY OF HYDROGEN-BOND .12. AMIDE HYDROGEN-BONDING IN FORMAMIDE-WATER AND FORMAMIDE-FORMALDEHYDE SYSTEMS [J].
DELBENE, JE .
JOURNAL OF CHEMICAL PHYSICS, 1975, 62 (05) :1961-1970
[7]   MOLECULAR-ORBITAL THEORY OF HYDROGEN-BOND .7. SERIES OF DIMERS HAVING AMMONIA AS PROTON ACCEPTOR [J].
DELBENE, JE .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1973, 95 (17) :5460-5465
[8]   THEORY OF MOLECULAR-INTERACTIONS .3. COMPARISON OF STUDIES OF H2O POLYMERS USING DIFFERENT MOLECULAR-ORBITAL BASIS SETS [J].
DELBENE, JE ;
POPLE, JA .
JOURNAL OF CHEMICAL PHYSICS, 1973, 58 (09) :3605-3608
[9]  
DELBENE JE, 1971, J CHEM PHYS, V55, P4633, DOI 10.1063/1.1676800
[10]   SYSTEMATIC STUDY OF 9 HYDROGEN-BONDED DIMERS INVOLVING NH3, OH2, AND HF [J].
DILL, JD ;
ALLEN, LC ;
TOPP, WC ;
POPLE, JA .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1975, 97 (25) :7220-7226