1,1′-Diphenyl-3,3′-(p-phenylenedicarbonyl)dithiourea

被引:7
作者
Hung, Wong W. [1 ]
Hassan, Ibrahim N. [1 ]
Yamin, Bohari M. [1 ]
Kassim, Mohammad B. [1 ]
机构
[1] Univ Kebangsaan Malaysia, Fac Sci & Technol, Sch Chem Sci & Food Technol, Bangi Selangor 43600, Malaysia
来源
ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE | 2010年 / 66卷
关键词
Data-to-parameter ratio = 13.3; Mean σ(C-C) = 0.004 Å; R factor = 0.051; Single-crystal X-ray study; T = 273 K; WR factor = 0.113;
D O I
10.1107/S1600536809055834
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
The molecule of the title compound, C(22)H(18)N(4)O(2)S(2), lies across a crystallographic inversion centre. The central benzene ring forms dihedral angles of 29.39 (9) and 79.11 (12)degrees, respectively, with the thiourea unit and the terminal phenyl ring. Intramolecular N-H center dot center dot center dot O hydrogen bonds generate two S( 6) ring motifs. In the crystal, molecules are linked into chains along [1 (1) over bar0] by intermolecular N-H center dot center dot center dot S hydrogen bonds.
引用
收藏
页码:O314 / U2006
页数:8
相关论文
共 7 条
  • [1] TABLES OF BOND LENGTHS DETERMINED BY X-RAY AND NEUTRON-DIFFRACTION .1. BOND LENGTHS IN ORGANIC-COMPOUNDS
    ALLEN, FH
    KENNARD, O
    WATSON, DG
    BRAMMER, L
    ORPEN, AG
    TAYLOR, R
    [J]. JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2, 1987, (12): : S1 - S19
  • [2] Bruker, 2000, SMART SAINT SADABS
  • [3] N-benzoyl-N′-(3-pyridyl)thiourea
    Dong, Wen-Kui
    Yang, Xiao-Qing
    Feng, Jian-Hua
    [J]. ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2006, 62 : O3459 - O3460
  • [4] Ethyl 2-(3-benzoylthioureido)acetate
    Hassan, Ibrahim N.
    Yamin, Bohari M.
    Kassim, Mohammad B.
    [J]. ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE, 2008, 64 : O1727 - U1653
  • [5] A short history of SHELX
    Sheldrick, George M.
    [J]. ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES, 2008, 64 : 112 - 122
  • [6] Structure validation in chemical crystallography
    Spek, Anthony L.
    [J]. ACTA CRYSTALLOGRAPHICA SECTION D-STRUCTURAL BIOLOGY, 2009, 65 : 148 - 155
  • [7] 1-(2-Morpholinoethyl)-3-(3-phenylacryloyl)thiourea
    Yamin, BM
    Hassan, IN
    [J]. ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS, 2004, 60 : O2513 - O2514