Hydrogen bonding and C-H•••O interactions in bis(4-carboxyquinolinium) sulfate monohydrate

被引:0
|
作者
Dobson, AJ [1 ]
Gerkin, RE [1 ]
机构
[1] Ohio State Univ, Dept Chem, Columbus, OH 43210 USA
关键词
D O I
10.1107/S0108270199010586
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
The title substance, 2C(10)H(8)NO(2)(+)-SO42-. H2O, crystallized in the centrosymmetric space group P (1) over bar with two organic cations, one sulfate ion and one water molecule in the asymmetric unit. Seven leading intermolecular hydrogen bonds are formed in this structure: two N-H ... O bonds have N ... O distances of 2.592(3) and 2.650 (3) Angstrom, while five O-H ... O bonds have O ... O distances ranging from 2.493(2) to 3.072(3) Angstrom. All of the potential donors are involved in these bonds, but three of the potential nine acceptors are not. The H and O atoms in all these hydrogen bonds are ordered. The hydrogen bonds form a three-dimensional network. In addition, there are nine significant C-H ... O interactions for which the H ... O distances are less than the corresponding van der Waals radii sum. The dihedral angle between the best-fit quinoline core plane and the carboxyl group plane is 35.2(3)degrees for one of the organic cations and 6.4(4)degrees for the other.
引用
收藏
页码:2142 / 2145
页数:4
相关论文
共 50 条
  • [1] Hydrogen bonding and C-H-X interactions in two triclinic phases of 4-carboxyquinolinium chloride monohydrate
    Dobson, AJ
    Gerkin, RE
    [J]. ACTA CRYSTALLOGRAPHICA SECTION C-CRYSTAL STRUCTURE COMMUNICATIONS, 1999, 55 : 1499 - 1503
  • [2] Hydrogen bonding and C-H•••O interactions in 4-phenanthrenemethanol at 150 K
    Gerkin, RE
    [J]. ACTA CRYSTALLOGRAPHICA SECTION C-STRUCTURAL CHEMISTRY, 2000, 56 : 1287 - 1288
  • [3] C-H O HYDROGEN BONDING
    FERGUSON, G
    TYRRELL, J
    [J]. CHEMICAL COMMUNICATIONS, 1965, (10) : 195 - &
  • [4] Hydrogen bonding patterns in bis(pyrimethamine hydrogen sulfate) monohydrate
    Devi, Periasamy
    Muthiah, P. Thomas
    Bocelli, Gabriele
    Cantoni, Andrea
    [J]. JOURNAL OF CHEMICAL CRYSTALLOGRAPHY, 2006, 36 (12) : 857 - 861
  • [5] Hydrogen bonding patterns in bis(pyrimethamine hydrogen sulfate) monohydrate
    Periasamy Devi
    P. Thomas Muthiah
    Gabriele Bocelli
    Andrea Cantoni
    [J]. Journal of Chemical Crystallography, 2006, 36 : 857 - 861
  • [6] Are solvent effects important for intramolecular C-H•••O- hydrogen bonding interactions?
    Wang, Jinhu
    Shao, Linjun
    Yan, Peng
    Liu, Chunli
    Liu, Xuejing
    Zhang, Xian M.
    [J]. JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 2019, 32 (04)
  • [7] Topological and NBO analysis of hydrogen bonding interactions involving C-H•••O bonds
    Sosa, GL
    Peruchena, NM
    Contreras, RH
    Castro, EA
    [J]. JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 2002, 577 (2-3): : 219 - 228
  • [8] Cooperative C≡C-H⋯O-H⋯O hydrogen bonding in a crystalline alkynol
    K. Subramanian
    S. Lakshmi
    K. Rajagopalan
    Thomas Steiner
    Evgeni B. Starikov
    [J]. Journal of Chemical Crystallography, 1998, 28 : 581 - 584
  • [9] June Sutor and the C-H ••• O hydrogen bonding controversy
    Schwalbe, Carl H.
    [J]. CRYSTALLOGRAPHY REVIEWS, 2012, 18 (03) : 189 - 204
  • [10] A C-H•••O=C hydrogen bond?: Intramolecular hydrogen bonding in a novel semirubin
    Huggins, MT
    Lightner, DA
    [J]. JOURNAL OF ORGANIC CHEMISTRY, 2001, 66 (25): : 8402 - 8410