Molecule FYI-1000381

Home > Molecule

A

Molecule Summary:

ID: FYI-1000381
SMILES: Cl/C/1=C/C=C\\N=Cl1

Received at FYIcenter.com on: 2021-04-30

Molecule ID: FYI-1000381 Edit

Molecule Structure SMILES String: Cl/C/1=C/C=CN=Cl1

Download SDF Download SVG Structure in 2D SDF:

FYI-1000381
FYIcenter.com

  7  7  0  0  0  0  0  0  0  0999 V2000
    2.4249    0.7000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.8000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.7000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.6058    2.8519    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  6  1  2  0  0  0  0
  2  7  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1000381-3D
FYIcenter.com

 10 10  0  0  0  0  0  0  0  0999 V2000
    0.6316   -2.4531    0.0561 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.3766   -2.6400    0.0559 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0015   -3.8306    0.0554 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5125   -3.9582    0.0554 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4028   -2.9145    0.0559 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0018   -1.5413    0.0565 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.4712   -1.3281    0.0565 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.4075   -4.7389    0.0551 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9175   -4.9654    0.0549 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4645   -3.1390    0.0559 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  7  1  0  0  0  0
  3  4  1  0  0  0  0
  3  8  1  0  0  0  0
  4  5  2  0  0  0  0
  4  9  1  0  0  0  0
  5  6  1  0  0  0  0
  5 10  1  0  0  0  0
  6  7  2  3  0  0  0
M  END
$$$$

✍: FYIcenter.com

2021-06-20, 753👍, 0💬