Molecule Editor

Molecule ID: FYI-1016174 Edit

Molecule Structure InChIKey: IYZWDNSAERCBJA-UHFFFAOYSA-N

Molecule Structure SMILES String: FC1=C(F)C(F)=C(F)C(F)C1

Download SDF Download SVG Structure in 2D SDF:

FYI-1016174
FYIcenter.com

 11 11  0  0  0  0  0  0  0  0999 V2000
    4.8497    4.2000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    4.2000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    3.5000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2124    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    1.4000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6373    2.1000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    0.0000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    1.4000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    4.2000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.4249    5.6000    0.0000 F   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  0  0  0  0
  3  2  1  0  0  0  0
  4  3  2  0  0  0  0
  5  4  1  0  0  0  0
  6  5  2  0  0  0  0
  7  6  1  0  0  0  0
  7  2  1  0  0  0  0
  8  6  1  0  0  0  0
  9  5  1  0  0  0  0
 10  4  1  0  0  0  0
 11  3  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016174-3D
FYIcenter.com

 14 14  0     1  0  0  0  0  0999 V2000
    1.4169    1.8613    0.9714 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.6143   -0.6110   -0.2564 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6884    0.9588   -0.0540 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.6227   -2.3781    0.0301 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9442   -1.5770    0.3713 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.0776    1.3078   -0.2303 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.3866    1.6872   -0.5261 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3400   -0.1692   -0.1767 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3834    0.6242   -0.1550 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3505   -1.0595   -0.0399 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0194   -0.6446    0.0657 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7275    1.7700   -0.9807 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5004    1.8829   -1.5994 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6362    2.6128    0.0047 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  6  1  0  0  0  0
  2  8  1  0  0  0  0
  3  9  1  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6 12  1  0  0  0  0
  7  9  1  0  0  0  0
  7 13  1  0  0  0  0
  7 14  1  0  0  0  0
  8 10  2  0  0  0  0
  9 11  2  0  0  0  0
 10 11  1  0  0  0  0
M  END
$$$$