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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)CCC)[Si](C)(C)C4=C([CH-]C5=C4C(=CC=C5)C6=CC=C(C=C6)CCC)CCCC.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CCCCC1=C(C2=C([CH-]1)C=CC=C2C3=CC=C(C=C3)CCC)[Si](C)(C)C4=C([CH-]C5=C4C(=CC=C5)C6=CC=C(C=C6)CCC)CCCC.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C46H54Si.2ClH.Zr/c1-7-11-17-39-31-37-19-13-21-41(35-27-23-33(15-9-3)24-28-35)43(37)45(39)47(5,6)46-40(18-12-8-2)32-38-20-14-22-42(44(38)46)36-29-25-34(16-10-4)26-30-36;;;/h13-14,19-32H,7-12,15-18H2,1-6H3;2*1H;/q-2;;;+4/p-2