Molecule FYI-1016211

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Molecule Summary:

ID: FYI-1016211
Names:
InChIKey: ZSSKXXIZCNNKCZ-UHFFFAOYSA-N
SMILES: FC1=C(Cl)CC(Cl)C(F)=N1

Received at FYIcenter.com on: 2025-11-29

Molecule ID: FYI-1016211 Edit

Molecule Structure InChIKey: ZSSKXXIZCNNKCZ-UHFFFAOYSA-N

Molecule Structure SMILES String: FC1=C(Cl)CC(Cl)C(F)=N1

Download SDF Download SVG Structure in 2D SDF:

FYI-1016211
FYIcenter.com

 10 10  0  0  0  0  0  0  0  0999 V2000
    4.8497    4.2000    0.0000 Cl  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 N   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 Cl  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
    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  3  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1016211-3D
FYIcenter.com

 13 13  0  0  1  0  0  0  0  0999 V2000
    1.0638   -0.1296    0.0328 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.4127   -0.0586   -0.0028 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9954    1.1467   -0.0296 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0679    2.6030   -0.0210 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.4760    1.3205   -0.0845 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2446    0.0029   -0.0422 C   0  0  3  0  0  0  0  0  0  0  0  0
    6.2659   -0.0937    1.4246 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.3658   -1.2240   -0.0529 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9804   -2.4162   -0.1085 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.0718   -1.2535   -0.0342 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7941    1.9917    0.7243 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7303    1.8379   -1.0187 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9274   -0.0683   -0.8950 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 10  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  5  6  1  0  0  0  0
  5 11  1  0  0  0  0
  5 12  1  0  0  0  0
  6  7  1  0  0  0  0
  6  8  1  0  0  0  0
  6 13  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
M  END
$$$$

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2025-12-09, 448👍, 0💬