dimethylsilylidenezirconium(2+); 2-ethyl-4-(2,4,6-trimethylphenyl)-1H-inden-1-ide; dichloride

Systemtic Name: dimethylsilylidenezirconium(2+); 2-ethyl-4-(2,4,6-trimethylphenyl)-1H-inden-1-ide; dichloride Openeye Name: dimethylsilylidenezirconium(2+); 2-ethyl-4-(2,4,6-trimethylphenyl)-1H-inden-1-ide; dichloride CAS Name: dimethylsilylidenezirconium(2+); 2-ethyl-4-(2,4,6-trimethylphenyl)-1H-inden-1-ide; dichloride IUPAC Name: dimethylsilylidenezirconium(2+); 2-ethyl-4-(2,4,6-trimethylphenyl)-1H-inden-1-ide; dichloride Traditional Name: dimethylsilylidenezirconium(2+); 2-ethyl-4-mesityl-1H-inden-1-ide; dichloride Formula: C84H96Cl2Si2Zr2-2 MolecularWeight: 1415.18604

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C([CH-]1)C=CC=C2C3=C(C=C(C=C3C)C)C.CCC1=CC2=C([CH-]1)C=CC=C2C3=C(C=C(C=C3C)C)C.CCC1=CC2=C([CH-]1)C=CC=C2C3=C(C=C(C=C3C)C)C.CCC1=CC2=C([CH-]1)C=CC=C2C3=C(C=C(C=C3C)C)C.C[Si](=[Zr+2])C.C[Si](=[Zr+2])C.[Cl-].[Cl-]

Isomeric SMILES

CCC1=CC2=C([CH-]1)C=CC=C2C3=C(C=C(C=C3C)C)C.CCC1=CC2=C([CH-]1)C=CC=C2C3=C(C=C(C=C3C)C)C.CCC1=CC2=C([CH-]1)C=CC=C2C3=C(C=C(C=C3C)C)C.CCC1=CC2=C([CH-]1)C=CC=C2C3=C(C=C(C=C3C)C)C.C[Si](=[Zr+2])C.C[Si](=[Zr+2])C.[Cl-].[Cl-]

InChI

InChI=1S/4C20H21.2C2H6Si.2ClH.2Zr/c4*1-5-16-11-17-7-6-8-18(19(17)12-16)20-14(3)9-13(2)10-15(20)4;2*1-3-2;;;;/h4*6-12H,5H2,1-4H3;2*1-2H3;2*1H;;/q4*-1;;;;;2*+2/p-2