4-氯-6-(n-丙基-d7)-嘧啶结构式

4-氯-6-(n-丙基-d7)-嘧啶
中文名称:4-氯-6-(n-丙基-d7)-嘧啶
英文名称:4-Chloro-6-(n-propyl-d7)-pyrimidine
CAS No.:1185307-00-9
分子式:C7H2D7ClN2 分子量:163.66
4-氯-6-(n-丙基-d7)-嘧啶 数据
Mol:
 D   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0566   -1.1822    0.0000 D   0  0  0  0  0  0  0  0  0  0  0  0
    1.4853    0.6602    0.0000 D   0  0  0  0  0  0  0  0  0  0  0  0
    0.6599    0.6602    0.0000 D   0  0  0  0  0  0  0  0  0  0  0  0
    2.5004   -0.0544    0.0000 D   0  0  0  0  0  0  0  0  0  0  0  0
    2.1992   -1.1822    0.0000 D   0  0  0  0  0  0  0  0  0  0  0  0
    1.3738   -1.1822    0.0000 D   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0     0  0
  1  3  1  0     0  0
  1 11  1  0     0  0
  1 12  1  0     0  0
  2  4  1  0     0  0
  2 13  1  0     0  0
  2 14  1  0     0  0
  3  5  1  0     0  0
  3  6  2  0     0  0
  4 15  1  0     0  0
  4 16  1  0     0  0
  4 17  1  0     0  0
  5  7  2  0     0  0
  6  8  1  0     0  0
  7  9  1  0     0  0
  7 10  1  0     0  0
  8 10  2  0     0  0
M  END                                
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4-氯-6-(n-丙基-d7)-嘧啶 Smile 编码:
C([2H])([2H])(C1=NC=NC(Cl)=C1)C([2H])([2H])C([2H])([2H])[2H]
4-氯-6-(n-丙基-d7)-嘧啶 InChi 编码:
1S/C7H9ClN2/c1-2-3-6-4-7(8)10-5-9-6/h4-5H,2-3H2,1H3
4-氯-6-(n-丙基-d7)-嘧啶 InChiKey 编码:
PGPZIGLZSPQJBD-UHFFFAOYSA-N