bis[4-(4-tert-butylphenyl)-2,3-dimethyl-1H-inden-1-id-5-yl]-dimethyl-silane; zirconium(4+); dichloride

Systemtic Name: bis[4-(4-tert-butylphenyl)-2,3-dimethyl-1H-inden-1-id-5-yl]-dimethyl-silane; zirconium(4+); dichloride Openeye Name: bis[4-(4-tert-butylphenyl)-2,3-dimethyl-1H-inden-1-id-5-yl]-dimethyl-silane; zirconium(4+); dichloride CAS Name: bis[4-(4-tert-butylphenyl)-2,3-dimethyl-1H-inden-1-id-5-yl]-dimethylsilane; zirconium(4+); dichloride IUPAC Name: bis[4-(4-tert-butylphenyl)-2,3-dimethyl-1H-inden-1-id-5-yl]-dimethylsilane; zirconium(4+); dichloride Traditional Name: bis[4-(4-tert-butylphenyl)-2,3-dimethyl-1H-inden-1-id-5-yl]-dimethyl-silane; zirconium(4+); dichloride Formula: C44H50Cl2SiZr MolecularWeight: 769.0833

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C([CH-]1)C=CC(=C2C3=CC=C(C=C3)C(C)(C)C)[Si](C)(C)C4=C(C5=C([CH-]C(=C5C)C)C=C4)C6=CC=C(C=C6)C(C)(C)C)C.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC1=C(C2=C([CH-]1)C=CC(=C2C3=CC=C(C=C3)C(C)(C)C)[Si](C)(C)C4=C(C5=C([CH-]C(=C5C)C)C=C4)C6=CC=C(C=C6)C(C)(C)C)C.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C44H50Si.2ClH.Zr/c1-27-25-33-17-23-37(41(39(33)29(27)3)31-13-19-35(20-14-31)43(5,6)7)45(11,12)38-24-18-34-26-28(2)30(4)40(34)42(38)32-15-21-36(22-16-32)44(8,9)10;;;/h13-26H,1-12H3;2*1H;/q-2;;;+4/p-2