cyclopenta-1,3-diene; iron(2+); tri(cyclopenta-1,4-dien-1-yl)phosphane

Systemtic Name: cyclopenta-1,3-diene; iron(2+); tri(cyclopenta-1,4-dien-1-yl)phosphane Openeye Name: triferrous; cyclopenta-1,3-diene; tri(cyclopenta-1,4-dien-1-yl)phosphane CAS Name: cyclopenta-1,3-diene; iron(2+); tris(1-cyclopenta-1,4-dienyl)phosphine IUPAC Name: cyclopenta-1,3-diene; iron(2+); tri(cyclopenta-1,4-dien-1-yl)phosphane Traditional Name: triferrous; cyclopenta-1,3-diene; tri(cyclopenta-1,4-dien-1-yl)phosphine Formula: C30H27Fe3P MolecularWeight: 586.044141

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC(=C1)P(C2=C[CH-]C=C2)C3=C[CH-]C=C3.[Fe+2].[Fe+2].[Fe+2]

Isomeric SMILES

[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.[CH-]1C=CC(=C1)P(C2=C[CH-]C=C2)C3=C[CH-]C=C3.[Fe+2].[Fe+2].[Fe+2]

InChI

InChI=1S/C15H12P.3C5H5.3Fe/c1-2-8-13(7-1)16(14-9-3-4-10-14)15-11-5-6-12-15;3*1-2-4-5-3-1;;;/h1-12H;3*1-5H;;;/q-3;3*-1;3*+2