Topological analysis of hydrogen bonding interactions involving C-H...O bonds

被引：34
|
作者：
Sosa, GL
Peruchena, N
Contreras, RH
Castro, EA
机构：
[1] NATL UNIV LA PLATA, FAC CIENCIAS EXACTAS, DEPT QUIM, CEQUINOR, RA-1900 LA PLATA, ARGENTINA
[2] UNIV BUENOS AIRES, FAC CIENCIAS EXACTAS & NAT, DEPT FIS, RA-1428 BUENOS AIRES, DF, ARGENTINA
[3] UNIV NACL NORDESTE, FAC CEINCIAS EXACTAS & NAT & AGRIMENSURA, CORRIENTES, ARGENTINA
来源：
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM | 1997年 / 401卷 / 1-2期
关键词：
hydrogen bonding; topological analysis;
D O I：
10.1016/S0166-1280(96)05032-4
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：
A topological analysis of two model systems in which different C-H...O hydrogen bonds exist is performed in order to characterize them. It is found that it is necessary to analyze the topological properties of the acceptor atom involved in the hydrogen bond since several parameters are qualitatively different in both complexes. This behaviour seems to suggest a way of identifying these bonds. (C) 1997 Elsevier Science B.V.
引用
收藏
页码：77 / 85
页数：9
相关论文
共 50 条
  • [31] Hydrogen bonds involving the C-H link. XV. Non-bonding of triphenylmethane hydrogen atoms
    Marvel, CS
    Harkema, J
    JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1941, 63 : 2221 - 2222
  • [32] CALORIMETRIC AND NMR STUDIES OF HYDROGEN BONDING INVOLVING C-H BONDS .1. CHLOROFORM AND PYRIDINE
    FINDLAY, TJV
    KENIRY, JS
    KIDMAN, AD
    PICKLES, VA
    TRANSACTIONS OF THE FARADAY SOCIETY, 1967, 63 (532P): : 846 - &
  • [33] C-H O HYDROGEN BONDING
    FERGUSON, G
    TYRRELL, J
    CHEMICAL COMMUNICATIONS, 1965, (10) : 195 - &
  • [34] Very strong C-H•••O, N-H•••O, and O-H•••O hydrogen bonds involving a cyclic phosphate
    Swamy, KCK
    Kumaraswamy, S
    Kommana, P
    JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2001, 123 (50) : 12642 - 12649
  • [35] High Z′ polymorphs have shorter C-H•••O interactions and O-H•••O hydrogen bonds
    Babu, N. Jagadeesh
    Nangia, Ashwini
    CRYSTENGCOMM, 2007, 9 (11): : 980 - 983
  • [36] THE ROLE PLAYED BY C-H...O AND C-H...N INTERACTIONS IN DETERMINING MOLECULAR PACKING AND CONFORMATION
    BERKOVITCHYELLIN, Z
    LEISEROWITZ, L
    ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1984, 40 (APR): : 159 - 165
  • [37] Electronic mechanisms of intra and intermolecular J couplings in systems with C-H...O interactions
    Giribet, CG
    de Azua, MCR
    Vizioli, CV
    Cavasotto, CN
    INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES, 2003, 4 (04) : 203 - 217
  • [38] Spectrophotometric determination of the transition system for interactions involving model -O-H•••N hydrogen bonds in acetonitrile
    Magonski, J
    JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2002, 15 (04) : 204 - 210
  • [39] HYDROGEN-BONDS INVOLVING POLAR C-H GROUPS
    HARLOW, RL
    LI, C
    SAMMES, MP
    ACTA CRYSTALLOGRAPHICA SECTION A, 1984, 40 : C265 - C265
  • [40] ANALYSIS OF C-H•••O HYDROGEN BONDS IN BETA SHEETS.
    Pattabhi, Vasantha
    Fabiola, G. Felcy
    Krishnaswamy, S.
    ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES, 1996, 52 : C238 - C238
12345