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

Systemtic Name: bis[2-ethyl-7-(4-methoxyphenyl)-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride Openeye Name: bis[2-ethyl-7-(4-methoxyphenyl)-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride CAS Name: bis[2-ethyl-7-(4-methoxyphenyl)-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(4+); dichloride IUPAC Name: bis[2-ethyl-7-(4-methoxyphenyl)-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(4+); dichloride Traditional Name: bis[2-ethyl-7-(4-methoxyphenyl)-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride Formula: C38H38Cl2O2SiZr MolecularWeight: 716.92262

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C38H38O2Si.2ClH.Zr/c1-7-25-23-29-11-9-13-33(27-15-19-31(39-3)20-16-27)35(29)37(25)41(5,6)38-26(8-2)24-30-12-10-14-34(36(30)38)28-17-21-32(40-4)22-18-28;;;/h9-24H,7-8H2,1-6H3;2*1H;/q-2;;;+4/p-2