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

Systemtic Name: bis[7-(4-tert-butylphenyl)-2-ethyl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride Openeye Name: bis[7-(4-tert-butylphenyl)-2-ethyl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride CAS Name: bis[7-(4-tert-butylphenyl)-2-ethyl-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(4+); dichloride IUPAC Name: bis[7-(4-tert-butylphenyl)-2-ethyl-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(4+); dichloride Traditional Name: bis[7-(4-tert-butylphenyl)-2-ethyl-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride Formula: C44H50Cl2SiZr MolecularWeight: 769.0833

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C(C)(C)C)[Si](C)(C)C4=C([CH-]C5=C4C(=CC=C5)C6=CC=C(C=C6)C(C)(C)C)CC.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CCC1=C(C2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)C(C)(C)C)[Si](C)(C)C4=C([CH-]C5=C4C(=CC=C5)C6=CC=C(C=C6)C(C)(C)C)CC.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C44H50Si.2ClH.Zr/c1-11-29-27-33-15-13-17-37(31-19-23-35(24-20-31)43(3,4)5)39(33)41(29)45(9,10)42-30(12-2)28-34-16-14-18-38(40(34)42)32-21-25-36(26-22-32)44(6,7)8;;;/h13-28H,11-12H2,1-10H3;2*1H;/q-2;;;+4/p-2