Molecule FYI-1005940

A

Molecule Summary:

ID: FYI-1005940
Names:
InChIKey: VOWOEBADKMXUBU-UHFFFAOYSA-J
SMILES: O.O=Cl[O-].O=Cl[O-].O=Cl[O-].O=Cl[O-].O=O

Received at FYIcenter.com on: 2023-11-22

Molecule ID: FYI-1005940 Edit

Molecule Structure InChIKey: VOWOEBADKMXUBU-UHFFFAOYSA-J

Molecule Structure SMILES String: O.O=Cl[O-].O=Cl[O-].O=Cl[O-].O=Cl[O-].O=O

Download SDF Download SVG Structure in 2D SDF:

FYI-1005940
FYIcenter.com

 15  9  0  0  0  0  0  0  0  0999 V2000
    9.1800    3.3211    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.3403    3.3815    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.0247    3.8605    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    2.9522    2.9606    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3898    0.4788    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    4.7054    0.0000    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    5.7778    0.8999    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4788    2.4762    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.0000    1.1606    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.8998    0.0881    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7590    6.0814    0.0000 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.3802    6.3246    0.0000 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.4803    5.2521    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6600    6.4150    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4476    7.1150    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  2  1  0  0  0  0
  4  3  2  0  0  0  0
  6  5  1  0  0  0  0
  7  6  2  0  0  0  0
  9  8  1  0  0  0  0
 10  9  2  0  0  0  0
 12 11  1  0  0  0  0
 13 12  2  0  0  0  0
 15 14  2  0  0  0  0
M  END
$$$$

Download SDF Structure in 3D SDF:

FYI-1005940-3D
FYIcenter.com

 17 11  0  0  0  0  0  0  0  0999 V2000
    0.0349    0.4225   -0.4715 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5846    0.8917   -2.6832 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7570    0.1478   -2.0577 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    5.0722   -0.6748   -1.3580 O   0  5  0  0  0  0  0  0  0  0  0  0
    1.5890    3.1402    0.4676 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0819    2.9661    0.2232 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    4.7503    2.7661   -0.0464 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.8587    0.3303    3.1458 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3358    0.3896    2.7799 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.9848    0.4473    2.3627 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.5744   -2.5218    0.9117 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0955   -2.5501    0.8401 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    3.7952   -2.5744    0.7652 O   0  5  0  0  0  0  0  0  0  0  0  0
    0.9597   -2.5742   -2.3173 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7773   -1.6920   -3.0339 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9843    0.2773   -0.2313 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0626    1.1154   -1.1794 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  8  9  2  0  0  0  0
  9 10  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 14 15  2  0  0  0  0
M  END
$$$$

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2023-11-25, 2222👍, 0💬