Molecule Editor

Molecule ID: FYI-1003666 Edit

Molecule Structure InChIKey: CUDMPYFSXAYVJO-LISRRRQHSA-L

Molecule Structure SMILES String: Cc1ccccc1[N+]3=Cc2cc(Cl)cc(Cl)c2O[Fe]35([OH2+])([OH2+])Oc4c(Cl)cc(Cl)cc4C=[N+]5c6ccccc6C

Download SDF Download SVG Structure in 2D SDF:

FYI-1003666
FYIcenter.com

 39 44  0  0  0  0  0  0  0  0999 V2000
    4.7340    8.8829    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
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    2.3671    8.8829    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1835    8.1996    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    8.8829    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    1.1835    6.8330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3671    6.1497    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5506    6.8334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7340    6.1497    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7340    4.7831    0.0000 Fe  0  0  0  0  0  0  0  0  0  0  0  0
    3.6343    6.1557    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
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    7.1011    4.7831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2846    5.4664    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2846    6.8330    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    9.4680    4.7831    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.4680    3.4165    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    5.9176    5.4664    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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  4  3  1  0  0  0  0
  5  4  1  0  0  0  0
  6  4  2  0  0  0  0
  7  6  1  0  0  0  0
  8  7  2  0  0  0  0
  8  2  1  0  0  0  0
  9  8  1  0  0  0  0
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 21  7  1  0  0  0  0
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 38 31  1  0  0  0  0
 39 32  1  0  0  0  0
 39 10  1  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1003666-3D
FYIcenter.com

 63 68  0  0  0  0  0  0  0  0999 V2000
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   -2.0217    0.1312   -5.4945 C   0  0  0  0  0  0  0  0  0  0  0  0
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M  END
$$$$