carbon monoxide; cyclopentyl(diphenyl)phosphane; iron(2+); methanol; rhenium

Systemtic Name: carbon monoxide; cyclopentyl(diphenyl)phosphane; iron(2+); methanol; rhenium Openeye Name: ferrous; carbon monoxide; cyclopentyl(diphenyl)phosphane; methanol; rhenium CAS Name: carbon monoxide; cyclopentyl(diphenyl)phosphine; iron(2+); methanol; rhenium IUPAC Name: carbon monoxide; cyclopentyl(diphenyl)phosphane; iron(2+); methanol; rhenium Traditional Name: ferrous; carbon monoxide; cyclopentyl(diphenyl)phosphine; methanol; rhenium Formula: C42H36FeO8P2Re2+2 MolecularWeight: 1158.936962

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Descriptors Computed from Structure

Canonical SMILES:

CO.CO.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[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.[Fe+2].[Re].[Re]

Isomeric SMILES

CO.CO.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[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.[Fe+2].[Re].[Re]

InChI

InChI=1S/2C17H14P.2CH4O.6CO.Fe.2Re/c2*1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16;8*1-2;;;/h2*1-14H;2*2H,1H3;;;;;;;;;/q;;;;;;;;;;+2;;