1,1'-biphenyl; molybdenum; hexacarbonate

Systemtic Name: 1,1'-biphenyl; molybdenum; hexacarbonate Openeye Name: biphenyl; molybdenum; hexacarbonate CAS Name: 1,1'-biphenyl; molybdenum; hexacarbonate IUPAC Name: 1,1'-biphenyl; molybdenum; hexacarbonate Traditional Name: biphenyl; molybdenum; hexacarbonate Formula: C42H30Mo2O18-12 MolecularWeight: 1014.5568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=CC=C2.C1=CC=C(C=C1)C2=CC=CC=C2.C1=CC=C(C=C1)C2=CC=CC=C2.C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].[Mo].[Mo]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=CC=C2.C1=CC=C(C=C1)C2=CC=CC=C2.C1=CC=C(C=C1)C2=CC=CC=C2.C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].C(=O)([O-])[O-].[Mo].[Mo]

InChI

InChI=1S/3C12H10.6CH2O3.2Mo/c3*1-3-7-11(8-4-1)12-9-5-2-6-10-12;6*2-1(3)4;;/h3*1-10H;6*(H2,2,3,4);;/p-12