carbon monoxide; cyclopentanecarboxylic acid; cyclopentyl(diphenyl)phosphane; iron(2+); rhodium

Systemtic Name: carbon monoxide; cyclopentanecarboxylic acid; cyclopentyl(diphenyl)phosphane; iron(2+); rhodium Openeye Name: diferrous; carbon monoxide; cyclopentanecarboxylic acid; cyclopentyl(diphenyl)phosphane; rhodium CAS Name: carbon monoxide; cyclopentanecarboxylic acid; cyclopentyl(diphenyl)phosphine; iron(2+); rhodium IUPAC Name: carbon monoxide; cyclopentanecarboxylic acid; cyclopentyl(diphenyl)phosphane; iron(2+); rhodium Traditional Name: diferrous; carbon monoxide; cyclopentanecarboxylic acid; cyclopentyl(diphenyl)phosphine; rhodium Formula: C47H38Fe2O5P2Rh+4 MolecularWeight: 959.344642

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)[C]3[CH][CH][CH][CH]3.C1=CC=C(C=C1)P(C2=CC=CC=C2)[C]3[CH][CH][CH][CH]3.[CH]1[CH][CH][C]([CH]1)C(=O)O.[CH]1[CH][CH][C]([CH]1)C(=O)O.[Fe+2].[Fe+2].[Rh]

Isomeric SMILES

[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)[C]3[CH][CH][CH][CH]3.C1=CC=C(C=C1)P(C2=CC=CC=C2)[C]3[CH][CH][CH][CH]3.[CH]1[CH][CH][C]([CH]1)C(=O)O.[CH]1[CH][CH][C]([CH]1)C(=O)O.[Fe+2].[Fe+2].[Rh]

InChI

InChI=1S/2C17H14P.2C6H5O2.CO.2Fe.Rh/c2*1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16;2*7-6(8)5-3-1-2-4-5;1-2;;;/h2*1-14H;2*1-4H,(H,7,8);;;;/q;;;;;2*+2;