ethyl 2-diphenylphosphanylcyclopentane-1-carboxylate; gold(3+); iron(2+); chloride

Systemtic Name: ethyl 2-diphenylphosphanylcyclopentane-1-carboxylate; gold(3+); iron(2+); chloride Openeye Name: ferrous; ethyl 2-diphenylphosphanylcyclopentanecarboxylate; gold(3+); chloride CAS Name: 2-diphenylphosphino-1-cyclopentanecarboxylic acid ethyl ester; gold(3+); iron(2+); chloride IUPAC Name: ethyl 2-diphenylphosphanylcyclopentane-1-carboxylate; gold(3+); iron(2+); chloride Traditional Name: ferrous; 2-diphenylphosphinocyclopentanecarboxylic acid ethyl ester; gold(3+); chloride Formula: C40H36AuClFeO4P2+4 MolecularWeight: 930.923512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)[C]1[CH][CH][CH][C]1P(C2=CC=CC=C2)C3=CC=CC=C3.CCOC(=O)[C]1[CH][CH][CH][C]1P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Fe+2].[Au+3]

Isomeric SMILES

CCOC(=O)[C]1[CH][CH][CH][C]1P(C2=CC=CC=C2)C3=CC=CC=C3.CCOC(=O)[C]1[CH][CH][CH][C]1P(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-].[Fe+2].[Au+3]

InChI

InChI=1S/2C20H18O2P.Au.ClH.Fe/c2*1-2-22-20(21)18-14-9-15-19(18)23(16-10-5-3-6-11-16)17-12-7-4-8-13-17;;;/h2*3-15H,2H2,1H3;;1H;/q;;+3;;+2/p-1