1-butyl-1-inden-1-id-1-yl-siletane; cyclopenta-1,3-diene; zirconium(2+); dichloride

Systemtic Name: 1-butyl-1-inden-1-id-1-yl-siletane; cyclopenta-1,3-diene; zirconium(2+); dichloride Openeye Name: 1-butyl-1-inden-1-id-1-yl-siletane; cyclopenta-1,3-diene; zirconium(2+); dichloride CAS Name: 1-butyl-1-(1-inden-1-idyl)siletane; cyclopenta-1,3-diene; zirconium(2+); dichloride IUPAC Name: 1-butyl-1-inden-1-id-1-ylsiletane; cyclopenta-1,3-diene; zirconium(2+); dichloride Traditional Name: 1-butyl-1-inden-1-id-1-yl-siletane; cyclopenta-1,3-diene; zirconium(2+); dichloride Formula: C42H52Cl2Si2Zr2-2 MolecularWeight: 866.38728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[Si]1(CCC1)[C-]2C=CC3=CC=CC=C23.CCCC[Si]1(CCC1)[C-]2C=CC3=CC=CC=C23.C1C=CC=[C-]1.C1C=CC=[C-]1.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CCCC[Si]1(CCC1)[C-]2C=CC3=CC=CC=C23.CCCC[Si]1(CCC1)[C-]2C=CC3=CC=CC=C23.C1C=CC=[C-]1.C1C=CC=[C-]1.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/2C16H21Si.2C5H5.2ClH.2Zr/c2*1-2-3-11-17(12-6-13-17)16-10-9-14-7-4-5-8-15(14)16;2*1-2-4-5-3-1;;;;/h2*4-5,7-10H,2-3,6,11-13H2,1H3;2*1-3H,4H2;2*1H;;/q4*-1;;;2*+2/p-2