diphenylsilylidenezirconium(2+); 1-ethyl-2-(3-methylcyclopenta-1,3-dien-1-yl)benzene; dichloride

Systemtic Name: diphenylsilylidenezirconium(2+); 1-ethyl-2-(3-methylcyclopenta-1,3-dien-1-yl)benzene; dichloride Openeye Name: diphenylsilylidenezirconium(2+); 1-ethyl-2-(3-methylcyclopenta-1,3-dien-1-yl)benzene; dichloride CAS Name: diphenylsilylidenezirconium(2+); 1-ethyl-2-(3-methyl-1-cyclopenta-1,3-dienyl)benzene; dichloride IUPAC Name: diphenylsilylidenezirconium(2+); 1-ethyl-2-(3-methylcyclopenta-1,3-dien-1-yl)benzene; dichloride Traditional Name: diphenylsilylidenezirconium(2+); 1-ethyl-2-(3-methylcyclopenta-1,3-dien-1-yl)benzene; dichloride Formula: C80H80Cl2Si2Zr2-2 MolecularWeight: 1351.0162

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1C2=CC(=[C-]C2)C.CCC1=CC=CC=C1C2=CC(=[C-]C2)C.CCC1=CC=CC=C1C2=CC(=[C-]C2)C.CCC1=CC=CC=C1C2=CC(=[C-]C2)C.C1=CC=C(C=C1)[Si](=[Zr+2])C2=CC=CC=C2.C1=CC=C(C=C1)[Si](=[Zr+2])C2=CC=CC=C2.[Cl-].[Cl-]

Isomeric SMILES

CCC1=CC=CC=C1C2=CC(=[C-]C2)C.CCC1=CC=CC=C1C2=CC(=[C-]C2)C.CCC1=CC=CC=C1C2=CC(=[C-]C2)C.CCC1=CC=CC=C1C2=CC(=[C-]C2)C.C1=CC=C(C=C1)[Si](=[Zr+2])C2=CC=CC=C2.C1=CC=C(C=C1)[Si](=[Zr+2])C2=CC=CC=C2.[Cl-].[Cl-]

InChI

InChI=1S/4C14H15.2C12H10Si.2ClH.2Zr/c4*1-3-12-6-4-5-7-14(12)13-9-8-11(2)10-13;2*1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;;;;/h4*4-7,10H,3,9H2,1-2H3;2*1-10H;2*1H;;/q4*-1;;;;;2*+2/p-2