copper; cyclopenta-1,3-diene; iron; tricyclohexylphosphanium; triphenylphosphanium; tetracyanide

Systemtic Name: copper; cyclopenta-1,3-diene; iron; tricyclohexylphosphanium; triphenylphosphanium; tetracyanide Openeye Name: copper; cyclopenta-1,3-diene; iron; tricyclohexylphosphonium; triphenylphosphonium; tetracyanide CAS Name: copper; cyclopenta-1,3-diene; iron; tricyclohexylphosphonium; triphenylphosphonium; tetracyanide IUPAC Name: copper; cyclopenta-1,3-diene; iron; tricyclohexylphosphanium; triphenylphosphanium; tetracyanide Traditional Name: copper; cyclopenta-1,3-diene; iron; tricyclohexylphosphonium; triphenylphosphonium; tetracyanide Formula: C86H110Cu2Fe2N4P4-2 MolecularWeight: 1562.497444

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#N.[C-]#N.[C-]#N.[C-]#N.C1CCC(CC1)[PH+](C2CCCCC2)C3CCCCC3.C1CCC(CC1)[PH+](C2CCCCC2)C3CCCCC3.[CH-]1C=CC=C1.[CH-]1C=CC=C1.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Fe].[Fe].[Cu].[Cu]

Isomeric SMILES

[C-]#N.[C-]#N.[C-]#N.[C-]#N.C1CCC(CC1)[PH+](C2CCCCC2)C3CCCCC3.C1CCC(CC1)[PH+](C2CCCCC2)C3CCCCC3.[CH-]1C=CC=C1.[CH-]1C=CC=C1.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.C1=CC=C(C=C1)[PH+](C2=CC=CC=C2)C3=CC=CC=C3.[Fe].[Fe].[Cu].[Cu]

InChI

InChI=1S/2C18H33P.2C18H15P.2C5H5.4CN.2Cu.2Fe/c4*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;2*1-2-4-5-3-1;4*1-2;;;;/h2*16-18H,1-15H2;2*1-15H;2*1-5H;;;;;;;;/q;;;;6*-1;;;;/p+4