2-tert-butylcyclopenta-1,3-diene; dimethylsilylidenezirconium(2+); dichloride

Systemtic Name: 2-tert-butylcyclopenta-1,3-diene; dimethylsilylidenezirconium(2+); dichloride Openeye Name: 2-tert-butylcyclopenta-1,3-diene; dimethylsilylidenezirconium(2+); dichloride CAS Name: 2-tert-butylcyclopenta-1,3-diene; dimethylsilylidenezirconium(2+); dichloride IUPAC Name: 2-tert-butylcyclopenta-1,3-diene; dimethylsilylidenezirconium(2+); dichloride Traditional Name: 2-tert-butylcyclopenta-1,3-diene; dimethylsilylidenezirconium(2+); dichloride Formula: C40H64Cl2Si2Zr2-2 MolecularWeight: 854.46116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/4C9H13.2C2H6Si.2ClH.2Zr/c4*1-9(2,3)8-6-4-5-7-8;2*1-3-2;;;;/h4*4,6H,5H2,1-3H3;2*1-2H3;2*1H;;/q4*-1;;;;;2*+2/p-2