5-tert-butyl-2-ethyl-2-(2-phenylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride

Systemtic Name: 5-tert-butyl-2-ethyl-2-(2-phenylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride Openeye Name: 5-tert-butyl-2-ethyl-2-(2-phenylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 5-tert-butyl-2-ethyl-2-(2-phenylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride IUPAC Name: 5-tert-butyl-2-ethyl-2-(2-phenylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 5-tert-butyl-2-ethyl-2-(2-phenylphenyl)-1H-inden-1-ide; zirconium(2+); dichloride Formula: C27H27Cl2Zr- MolecularWeight: 513.63328

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C=C2C=C(C=CC2=[C-]1)C(C)(C)C)C3=CC=CC=C3C4=CC=CC=C4.[Cl-].[Cl-].[Zr+2]

Isomeric SMILES

CCC1(C=C2C=C(C=CC2=[C-]1)C(C)(C)C)C3=CC=CC=C3C4=CC=CC=C4.[Cl-].[Cl-].[Zr+2]

InChI

InChI=1S/C27H27.2ClH.Zr/c1-5-27(18-21-15-16-23(26(2,3)4)17-22(21)19-27)25-14-10-9-13-24(25)20-11-7-6-8-12-20;;;/h6-17,19H,5H2,1-4H3;2*1H;/q-1;;;+2/p-2