Structure of 3,6-diphenylpyrrolo[3,4-c]pyrrole-1-on-4-thione

被引：4
作者：
Mizuguchi, J [1 ]
机构：
[1] Yokohama Natl Univ, Fac Engn, Dept Appl Phys, Hodogaya Ku, Yokohama, Kanagawa 2408501, Japan
来源：
ZEITSCHRIFT FUR KRISTALLOGRAPHIE | 1999年 / 214卷 / 10期
关键词：
D O I：
10.1524/zkri.1999.214.10.677
中图分类号：
O7 [晶体学];
学科分类号：
0702 ; 070205 ; 0703 ; 080501 ;
摘要：
The title compound is a mono-thionated derivative of the diketopyrrolopyrrole red-pigment on the market. The crystal data are: C18H12N2OS, M-r = 304.37, monoclinic, P2(1)/n, a = 7.570(3) Angstrom, b = 4.869(3) Angstrom, c = 19.616(4) Angstrom, beta = 99.07(3)degrees, V = 714.0(6) Angstrom(3), Z = 2, D-x = 1.416, D-m = 1.372 Mg m(-3), graphite-monochromated CuKalpha, lambda = 1.5418 Angstrom, F(000) = 316.00, mu = 2.030 mm(-1), T = 296 K, R = 0.073 for 890 reflections. The phenyl rings are twisted out of the planar heterocyclic system by about 6.3(7)degrees. The oxygen and sulfur atoms are not entirely on the plane of the heterocyclic system, but are located slightly below and above the plane by about 0.17(1) Angstrom and 0.09(1) Angstrom, respectively. The molecules are stacked alternately (upside down) in a herringbone fashion along the b-axis.
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页码：677 / 680
页数：4
相关论文
共 24 条
[1]  
IQBAL A, 1988, J COATING TECHNOL, V60, P37
[2]  
Johnson C. K., 1976, ORNL5138
[3]   STRUCTURES OF 3,6-BIS(3-CHLOROPHENYL)PYRROLO[3,4-C]PYRROLE-1,4-DIONE AND 3,6-BIS(4-CHLOROPHENYL)PYRROLO[3,4-C]PYRROLE-1,4-DIONE [J].
MIZUGUCHI, J ;
GRUBENMANN, A ;
RIHS, G .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1993, 49 :1056-1060
[4]   A LARGE BATHOCHROMIC SHIFT FROM THE SOLUTION TO THE SOLID-STATE IN 1,4-DIKETO-3,6-DIPHENYL-PYRROLO-[3,4-C]-PYRROLE [J].
MIZUGUCHI, J ;
WOODEN, G .
BERICHTE DER BUNSEN-GESELLSCHAFT-PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 1991, 95 (10) :1264-1274
[5]   ELECTRONIC-SPECTRA OF 1,4-DIKETO-3,6-DIPHENYL-PYRROLO-[3,4-C]-PYRROLE IN THE SOLID-STATE [J].
MIZUGUCHI, J ;
RIHS, G .
BERICHTE DER BUNSEN-GESELLSCHAFT-PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 1992, 96 (04) :597-606
[6]   3,6-bis(4-tert-butylphenyl)-1,2,4,5-tetrahydropyrrolo[3,4-c]pyrrole-1,4-dione [J].
Mizuguchi, J .
ACTA CRYSTALLOGRAPHICA SECTION C-CRYSTAL STRUCTURE COMMUNICATIONS, 1998, 54 :1482-1484
[7]   STRUCTURES OF 3,6-DIPHENYLPYRROLO[3,4-C]PYRROLE-1,4-DIONE AND 2,5-DIMETHYL-3,6-DIPHENYLPYRROLO[3,4-C]PYRROLE-1,4-DIONE [J].
MIZUGUCHI, J ;
GRUBENMANN, A ;
WOODEN, G ;
RIHS, G .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1992, 48 :696-700
[8]  
MIZUGUCHI J, 1991, J IMAGING TECHNOL, V17, P123
[9]   ELECTROCHEMICAL COLOR-CHANGE OF 1,4-DIKETO-3,6-DIPHENYL-PYRROLO-[3,4-C]-PYRROLE [J].
MIZUGUCHI, J ;
ROCHAT, AC .
BERICHTE DER BUNSEN-GESELLSCHAFT-PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 1992, 96 (05) :708-711
[10]   SOLUTION AND SOLID-STATE PROPERTIES OF 1,4-DIKETO-3,6-BIS-(4'-PYRIDYL)-PYRROLO-[3,4-C]-PYRROLE ON PROTONATION AND DEPROTONATION [J].
MIZUGUCHI, J .
BERICHTE DER BUNSEN-GESELLSCHAFT-PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 1993, 97 (05) :684-693
123