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

Systemtic Name: bis[7-(4-butylphenyl)-2-methyl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride Openeye Name: bis[7-(4-butylphenyl)-2-methyl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride CAS Name: bis[7-(4-butylphenyl)-2-methyl-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(4+); dichloride IUPAC Name: bis[7-(4-butylphenyl)-2-methyl-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(4+); dichloride Traditional Name: bis[7-(4-butylphenyl)-2-methyl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride Formula: C42H46Cl2SiZr MolecularWeight: 741.03014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=CC=CC3=C2C(=C([CH-]3)C)[Si](C)(C)C4=C([CH-]C5=C4C(=CC=C5)C6=CC=C(C=C6)CCCC)C.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CC=CC3=C2C(=C([CH-]3)C)[Si](C)(C)C4=C([CH-]C5=C4C(=CC=C5)C6=CC=C(C=C6)CCCC)C.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C42H46Si.2ClH.Zr/c1-7-9-13-31-19-23-33(24-20-31)37-17-11-15-35-27-29(3)41(39(35)37)43(5,6)42-30(4)28-36-16-12-18-38(40(36)42)34-25-21-32(22-26-34)14-10-8-2;;;/h11-12,15-28H,7-10,13-14H2,1-6H3;2*1H;/q-2;;;+4/p-2