Molecule Editor

Molecule ID: FYI-1001663 Edit

Molecule Structure SMILES String: C(C=CBr)N

Download SDF Download SVG Structure in 2D SDF:

FYI-1001663
FYIcenter.com

  5  4  0  0  0  0  0  0  0  0999 V2000
    1.2124    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8497    0.0000    0.0000 Br  0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  2  0  0  0  0
  4  3  1  0  0  0  0
  5  1  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1001663-3D
FYIcenter.com

 11 10  0  0  0  0  0  0  0  0999 V2000
    1.0901    0.0380   -0.0078 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5770   -0.9759   -0.9740 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2047   -2.0046   -0.6271 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8605   -3.2633   -1.8200 Br  0  0  0  0  0  0  0  0  0  0  0  0
    2.5430    0.0457   -0.0331 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7404   -0.1608    1.0112 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7181    1.0266   -0.2966 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8600   -0.8372   -2.0152 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5161   -2.1842    0.3957 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8878   -0.8555    0.2954 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8842    0.7358    0.6340 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  5  1  0  0  0  0
  1  6  1  0  0  0  0
  1  7  1  0  0  0  0
  2  3  2  3  0  0  0
  2  8  1  0  0  0  0
  3  4  1  0  0  0  0
  3  9  1  0  0  0  0
  5 10  1  0  0  0  0
  5 11  1  0  0  0  0
M  END
$$$$