bis[2-hexyl-7-(4-methylphenyl)-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride

Systemtic Name: bis[2-hexyl-7-(4-methylphenyl)-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride Openeye Name: bis[2-hexyl-7-(p-tolyl)-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride CAS Name: bis[2-hexyl-7-(4-methylphenyl)-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(4+); dichloride IUPAC Name: bis[2-hexyl-7-(4-methylphenyl)-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(4+); dichloride Traditional Name: bis[2-hexyl-7-(p-tolyl)-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride Formula: C46H54Cl2SiZr MolecularWeight: 797.13646

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C)[Si](C)(C)C4=C([CH-]C5=C4C(=CC=C5)C6=CC=C(C=C6)C)CCCCCC.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CCCCCCC1=C(C2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C)[Si](C)(C)C4=C([CH-]C5=C4C(=CC=C5)C6=CC=C(C=C6)C)CCCCCC.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C46H54Si.2ClH.Zr/c1-7-9-11-13-17-39-31-37-19-15-21-41(35-27-23-33(3)24-28-35)43(37)45(39)47(5,6)46-40(18-14-12-10-8-2)32-38-20-16-22-42(44(38)46)36-29-25-34(4)26-30-36;;;/h15-16,19-32H,7-14,17-18H2,1-6H3;2*1H;/q-2;;;+4/p-2