cyclopenta-1,3-diene; cyclopenta-2,4-dien-1-ylmethanediol; iron; tris(4-methylphenyl)stibane

Systemtic Name: cyclopenta-1,3-diene; cyclopenta-2,4-dien-1-ylmethanediol; iron; tris(4-methylphenyl)stibane Openeye Name: cyclopenta-1,3-diene; cyclopenta-2,4-dien-1-ylmethanediol; iron; tris-p-tolylstibane CAS Name: cyclopenta-1,3-diene; 1-cyclopenta-2,4-dienylmethanediol; iron; tris(4-methylphenyl)stibine IUPAC Name: cyclopenta-1,3-diene; cyclopenta-2,4-dien-1-ylmethanediol; iron; tris(4-methylphenyl)stibane Traditional Name: cyclopenta-1,3-diene; cyclopenta-2,4-dien-1-ylmethanediol; iron; tris-p-tolylstibine Formula: C43H45Fe2O4Sb-4 MolecularWeight: 859.265

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[Sb](C2=CC=C(C=C2)C)C3=CC=C(C=C3)C.[CH-]1C=CC=C1.[CH-]1C=CC=C1.C1=C[C-](C=C1)C(O)O.C1=C[C-](C=C1)C(O)O.[Fe].[Fe]

Isomeric SMILES

CC1=CC=C(C=C1)[Sb](C2=CC=C(C=C2)C)C3=CC=C(C=C3)C.[CH-]1C=CC=C1.[CH-]1C=CC=C1.C1=C[C-](C=C1)C(O)O.C1=C[C-](C=C1)C(O)O.[Fe].[Fe]

InChI

InChI=1S/3C7H7.2C6H7O2.2C5H5.2Fe.Sb/c3*1-7-5-3-2-4-6-7;2*7-6(8)5-3-1-2-4-5;2*1-2-4-5-3-1;;;/h3*3-6H,1H3;2*1-4,6-8H;2*1-5H;;;/q;;;4*-1;;;