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carbon monoxide; cyclopenta-1,3-diene; iron; thiobenzate

carbon monoxide; cyclopenta-1,3-diene; iron; thiobenzate

Systemtic Name:carbon monoxide; cyclopenta-1,3-diene; iron; thiobenzate
Openeye Name:carbon monoxide; cyclopenta-1,3-diene; iron; thiobenzate
CAS Name:carbon monoxide; cyclopenta-1,3-diene; iron; thiobenzate
IUPAC Name:carbon monoxide; cyclopenta-1,3-diene; iron; thiobenzate
Traditional Name:carbon monoxide; cyclopenta-1,3-diene; iron; thiobenzate
Formula: C14H10FeO3S-2
MolecularWeight: 314.1374
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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].[C-]#[O+].[CH-]1C=CC=C1.C1=CC=C(C=C1)C(=O)[S-].[Fe]


Isomeric SMILES

[C-]#[O+].[C-]#[O+].[CH-]1C=CC=C1.C1=CC=C(C=C1)C(=O)[S-].[Fe]


InChI

InChI=1S/C7H6OS.C5H5.2CO.Fe/c8-7(9)6-4-2-1-3-5-6;1-2-4-5-3-1;2*1-2;/h1-5H,(H,8,9);1-5H;;;/q;-1;;;/p-1


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