dimethylsilylidenezirconium(2+); 2-ethyl-4-(4-phenylphenyl)-1H-inden-1-ide; dichloride

Systemtic Name: dimethylsilylidenezirconium(2+); 2-ethyl-4-(4-phenylphenyl)-1H-inden-1-ide; dichloride Openeye Name: dimethylsilylidenezirconium(2+); 2-ethyl-4-(4-phenylphenyl)-1H-inden-1-ide; dichloride CAS Name: dimethylsilylidenezirconium(2+); 2-ethyl-4-(4-phenylphenyl)-1H-inden-1-ide; dichloride IUPAC Name: dimethylsilylidenezirconium(2+); 2-ethyl-4-(4-phenylphenyl)-1H-inden-1-ide; dichloride Traditional Name: dimethylsilylidenezirconium(2+); 2-ethyl-4-(4-phenylphenyl)-1H-inden-1-ide; dichloride Formula: C96H88Cl2Si2Zr2-2 MolecularWeight: 1551.25092

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C4=CC=CC=C4.CCC1=CC2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C4=CC=CC=C4.CCC1=CC2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C4=CC=CC=C4.CCC1=CC2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C4=CC=CC=C4.C[Si](=[Zr+2])C.C[Si](=[Zr+2])C.[Cl-].[Cl-]

Isomeric SMILES

CCC1=CC2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C4=CC=CC=C4.CCC1=CC2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C4=CC=CC=C4.CCC1=CC2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C4=CC=CC=C4.CCC1=CC2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C4=CC=CC=C4.C[Si](=[Zr+2])C.C[Si](=[Zr+2])C.[Cl-].[Cl-]

InChI

InChI=1S/4C23H19.2C2H6Si.2ClH.2Zr/c4*1-2-17-15-21-9-6-10-22(23(21)16-17)20-13-11-19(12-14-20)18-7-4-3-5-8-18;2*1-3-2;;;;/h4*3-16H,2H2,1H3;2*1-2H3;2*1H;;/q4*-1;;;;;2*+2/p-2