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

Systemtic Name: 2-phenyl-1H-inden-1-ide; 2-phenyl-1-(phenylmethyl)inden-1-ide; zirconium(2+); dichloride Openeye Name: 1-benzyl-2-phenyl-inden-1-ide; 2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride CAS Name: 2-phenyl-1H-inden-1-ide; 2-phenyl-1-(phenylmethyl)inden-1-ide; zirconium(2+); dichloride IUPAC Name: 1-benzyl-2-phenylinden-1-ide; 2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Traditional Name: 1-benzyl-2-phenyl-inden-1-ide; 2-phenyl-1H-inden-1-ide; zirconium(2+); dichloride Formula: C74H56Cl2Zr2-2 MolecularWeight: 1198.59044

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.C1=CC=C(C=C1)C[C-]2C3=CC=CC=C3C=C2C4=CC=CC=C4.C1=CC=C(C=C1)C[C-]2C3=CC=CC=C3C=C2C4=CC=CC=C4.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.[CH-]1C2=CC=CC=C2C=C1C3=CC=CC=C3.C1=CC=C(C=C1)C[C-]2C3=CC=CC=C3C=C2C4=CC=CC=C4.C1=CC=C(C=C1)C[C-]2C3=CC=CC=C3C=C2C4=CC=CC=C4.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/2C22H17.2C15H11.2ClH.2Zr/c2*1-3-9-17(10-4-1)15-22-20-14-8-7-13-19(20)16-21(22)18-11-5-2-6-12-18;2*1-2-6-12(7-3-1)15-10-13-8-4-5-9-14(13)11-15;;;;/h2*1-14,16H,15H2;2*1-11H;2*1H;;/q4*-1;;;2*+2/p-2