2,4,5-三苯基咪唑结构式

中文名称:2,4,5-三苯基咪唑
英文名称:2,4,5-Triphenylimidazole
CAS No.:484-47-9
分子式:C21H16N2 分子量:296.3651
2,4,5-三苯基咪唑 数据
Mol:
    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2845    2.5862    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8980    4.4607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2577    5.2457    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6173    4.4607    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6173    2.8907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2577    2.1057    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8980    2.8907    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  2  0  0  0  0
  4  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  1  1  0  0  0  0
  1  7  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11  7  2  0  0  0  0
 10 12  1  0  0  0  0
 12 13  2  0  0  0  0
 13 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 12  1  0  0  0  0
  9 18  1  0  0  0  0
 18 19  2  0  0  0  0
 19 20  1  0  0  0  0
 20 21  2  0  0  0  0
 21 22  1  0  0  0  0
 22 23  2  0  0  0  0
 23 18  1  0  0  0  0
M  END
                                
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2,4,5-三苯基咪唑 Smile 编码:
C1=CC=C(C=C1)C2=NC(C3=CC=CC=C3)=C(C4=CC=CC=C4)N2
2,4,5-三苯基咪唑 InChi 编码:
1S/C21H16N2/c1-4-10-16(11-5-1)19-20(17-12-6-2-7-13-17)23-21(22-19)18-14-8-3-9-15-18/h1-15H,(H,22,23)
2,4,5-三苯基咪唑 InChiKey 编码:
RNIPJYFZGXJSDD-UHFFFAOYSA-N