carbon monoxide; 3,5-dimethylpyrazol-2-ide; 3-diphenylphosphanylbenzoic acid; rhodium

Systemtic Name: carbon monoxide; 3,5-dimethylpyrazol-2-ide; 3-diphenylphosphanylbenzoic acid; rhodium Openeye Name: carbon monoxide; 3,5-dimethylpyrazol-2-ide; 3-diphenylphosphanylbenzoic acid; rhodium CAS Name: carbon monoxide; 3,5-dimethylpyrazol-2-ide; 3-diphenylphosphinobenzoic acid; rhodium IUPAC Name: carbon monoxide; 3,5-dimethylpyrazol-2-ide; 3-diphenylphosphanylbenzoic acid; rhodium Traditional Name: carbon monoxide; 3,5-dimethylpyrazol-2-ide; 3-diphenylphosphinobenzoic acid; rhodium Formula: C50H44N4O6P2Rh2-2 MolecularWeight: 1064.666082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=N[N-]1)C.CC1=CC(=N[N-]1)C.[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC(=C3)C(=O)O.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC(=C3)C(=O)O.[Rh].[Rh]

Isomeric SMILES

CC1=CC(=N[N-]1)C.CC1=CC(=N[N-]1)C.[C-]#[O+].[C-]#[O+].C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC(=C3)C(=O)O.C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC(=C3)C(=O)O.[Rh].[Rh]

InChI

InChI=1S/2C19H15O2P.2C5H7N2.2CO.2Rh/c2*20-19(21)15-8-7-13-18(14-15)22(16-9-3-1-4-10-16)17-11-5-2-6-12-17;2*1-4-3-5(2)7-6-4;2*1-2;;/h2*1-14H,(H,20,21);2*3H,1-2H3;;;;/q;;2*-1;;;;