dimethylsilylidenezirconium(2+); 2-hexyl-4-phenyl-1H-inden-1-ide; dichloride

Systemtic Name: dimethylsilylidenezirconium(2+); 2-hexyl-4-phenyl-1H-inden-1-ide; dichloride Openeye Name: dimethylsilylidenezirconium(2+); 2-hexyl-4-phenyl-1H-inden-1-ide; dichloride CAS Name: dimethylsilylidenezirconium(2+); 2-hexyl-4-phenyl-1H-inden-1-ide; dichloride IUPAC Name: dimethylsilylidenezirconium(2+); 2-hexyl-4-phenyl-1H-inden-1-ide; dichloride Traditional Name: dimethylsilylidenezirconium(2+); 2-hexyl-4-phenyl-1H-inden-1-ide; dichloride Formula: C88H104Cl2Si2Zr2-2 MolecularWeight: 1471.29236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CCCCCCC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CCCCCCC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CCCCCCC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.C[Si](=[Zr+2])C.C[Si](=[Zr+2])C.[Cl-].[Cl-]

Isomeric SMILES

CCCCCCC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CCCCCCC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CCCCCCC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.CCCCCCC1=CC2=C([CH-]1)C=CC=C2C3=CC=CC=C3.C[Si](=[Zr+2])C.C[Si](=[Zr+2])C.[Cl-].[Cl-]

InChI

InChI=1S/4C21H23.2C2H6Si.2ClH.2Zr/c4*1-2-3-4-6-10-17-15-19-13-9-14-20(21(19)16-17)18-11-7-5-8-12-18;2*1-3-2;;;;/h4*5,7-9,11-16H,2-4,6,10H2,1H3;2*1-2H3;2*1H;;/q4*-1;;;;;2*+2/p-2