benzaldehyde; cyclopentyl(diphenyl)phosphane; iron(2+); 2-methylpropan-2-ol; palladium

Systemtic Name: benzaldehyde; cyclopentyl(diphenyl)phosphane; iron(2+); 2-methylpropan-2-ol; palladium Openeye Name: ferrous; benzaldehyde; cyclopentyl(diphenyl)phosphane; 2-methylpropan-2-ol; palladium CAS Name: benzaldehyde; cyclopentyl(diphenyl)phosphine; iron(2+); 2-methyl-2-propanol; palladium IUPAC Name: benzaldehyde; cyclopentyl(diphenyl)phosphane; iron(2+); 2-methylpropan-2-ol; palladium Traditional Name: ferrous; benzaldehyde; cyclopentyl(diphenyl)phosphine; 2-methylpropan-2-ol; palladium Formula: C45H43FeO2P2Pd+ MolecularWeight: 840.034242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(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.C1=CC(=CC=[C-]1)C=O.[Fe+2].[Pd]

Isomeric SMILES

CC(C)(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.C1=CC(=CC=[C-]1)C=O.[Fe+2].[Pd]

InChI

InChI=1S/2C17H14P.C7H5O.C4H10O.Fe.Pd/c2*1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16;8-6-7-4-2-1-3-5-7;1-4(2,3)5;;/h2*1-14H;2-6H;5H,1-3H3;;/q;;-1;;+2;