2-(3,5-ditert-butylphenyl)-5-methyl-2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 2-(3,5-ditert-butylphenyl)-5-methyl-2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 2-(3,5-ditert-butylphenyl)-5-methyl-2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 2-(3,5-ditert-butylphenyl)-5-methyl-2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 2-(3,5-ditert-butylphenyl)-5-methyl-2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 2-(3,5-ditert-butylphenyl)-5-methyl-2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C30H33Cl2Zr- MolecularWeight: 555.71302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC([C-]=C2C=C1)(C3=CC=CC=C3)C4=CC(=CC(=C4)C(C)(C)C)C(C)(C)C.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CC1=CC2=CC([C-]=C2C=C1)(C3=CC=CC=C3)C4=CC(=CC(=C4)C(C)(C)C)C(C)(C)C.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C30H33.2ClH.Zr/c1-21-13-14-22-19-30(20-23(22)15-21,24-11-9-8-10-12-24)27-17-25(28(2,3)4)16-26(18-27)29(5,6)7;;;/h8-18,20H,1-7H3;2*1H;/q-1;;;+2/p-2