1-methyl-2-phenyl-inden-1-ide; 2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 1-methyl-2-phenyl-inden-1-ide; 2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 1-methyl-2-phenyl-inden-1-ide; 2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 1-methyl-2-phenylinden-1-ide; 2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 1-methyl-2-phenylinden-1-ide; 2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 1-methyl-2-phenyl-inden-1-ide; 2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C62H48Cl2Zr2-2 MolecularWeight: 1046.39852

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Descriptors Computed from Structure

Canonical SMILES:

C[C-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.C[C-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

C[C-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.C[C-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/2C16H13.2C15H11.2ClH.2Zr/c2*1-12-15-10-6-5-9-14(15)11-16(12)13-7-3-2-4-8-13;2*1-2-6-12(7-3-1)15-10-13-8-4-5-9-14(13)11-15;;;;/h2*2-11H,1H3;2*1-11H;2*1H;;/q4*-1;;;2*+2/p-2