cyclopenta-1,3-diene; 2-diphenylphosphaniumylethyl(diphenyl)phosphanium; iron; iron(6+); 6-[[2-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one; dicyanide

Systemtic Name: cyclopenta-1,3-diene; 2-diphenylphosphaniumylethyl(diphenyl)phosphanium; iron; iron(6+); 6-[[2-[(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)methylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one; dicyanide Openeye Name: cyclopenta-1,3-diene; 2-diphenylphosphaniumylethyl(diphenyl)phosphonium; iron; iron(6+); 6-[[2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]ethylamino]methylene]cyclohexa-2,4-dien-1-one; dicyanide CAS Name: cyclopenta-1,3-diene; 2-diphenylphosphiniumylethyl(diphenyl)phosphonium; iron; iron(6+); 6-[[2-[(6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]ethylamino]methylidene]-1-cyclohexa-2,4-dienone; dicyanide IUPAC Name: cyclopenta-1,3-diene; 2-diphenylphosphaniumylethyl(diphenyl)phosphanium; iron; iron(6+); 6-[[2-[(6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]ethylamino]methylidene]cyclohexa-2,4-dien-1-one; dicyanide Traditional Name: cyclopenta-1,3-diene; 2-diphenylphosphiniumylethyl(diphenyl)phosphonium; iron; iron(6+); 6-[[2-[(6-ketocyclohexa-2,4-dien-1-ylidene)methylamino]ethylamino]methylene]cyclohexa-2,4-dien-1-one; dicyanide Formula: C96H94Fe4N6O4P4+12 MolecularWeight: 1743.086404

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#N.[C-]#N.[CH-]1C=CC=C1.[CH-]1C=CC=C1.C1=CC=C(C=C1)[PH+](CC[PH+](C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)[PH+](CC[PH+](C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C1=CC(=CNCCNC=C2C=CC=CC2=O)C(=O)C=C1.C1=CC(=CNCCNC=C2C=CC=CC2=O)C(=O)C=C1.[Fe].[Fe].[Fe+6].[Fe+6]

Isomeric SMILES

[C-]#N.[C-]#N.[CH-]1C=CC=C1.[CH-]1C=CC=C1.C1=CC=C(C=C1)[PH+](CC[PH+](C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C1=CC=C(C=C1)[PH+](CC[PH+](C2=CC=CC=C2)C3=CC=CC=C3)C4=CC=CC=C4.C1=CC(=CNCCNC=C2C=CC=CC2=O)C(=O)C=C1.C1=CC(=CNCCNC=C2C=CC=CC2=O)C(=O)C=C1.[Fe].[Fe].[Fe+6].[Fe+6]

InChI

InChI=1S/2C26H24P2.2C16H16N2O2.2C5H5.2CN.4Fe/c2*1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;2*19-15-7-3-1-5-13(15)11-17-9-10-18-12-14-6-2-4-8-16(14)20;2*1-2-4-5-3-1;2*1-2;;;;/h2*1-20H,21-22H2;2*1-8,11-12,17-18H,9-10H2;2*1-5H;;;;;;/q;;;;4*-1;;;2*+6/p+4