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

Systemtic Name: dimethyl-bis[2-(2-methylpropyl)-7-naphthalen-1-yl-3H-inden-3-id-1-yl]silane; zirconium(4+); dichloride Openeye Name: bis[2-isobutyl-7-(1-naphthyl)-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride CAS Name: dimethyl-bis[2-(2-methylpropyl)-7-(1-naphthalenyl)-3H-inden-3-id-1-yl]silane; zirconium(4+); dichloride IUPAC Name: dimethyl-bis[2-(2-methylpropyl)-7-naphthalen-1-yl-3H-inden-3-id-1-yl]silane; zirconium(4+); dichloride Traditional Name: bis[2-isobutyl-7-(1-naphthyl)-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride Formula: C48H46Cl2SiZr MolecularWeight: 813.09434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C2=C([CH-]1)C=CC=C2C3=CC=CC4=CC=CC=C43)[Si](C)(C)C5=C([CH-]C6=C5C(=CC=C6)C7=CC=CC8=CC=CC=C87)CC(C)C.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC(C)CC1=C(C2=C([CH-]1)C=CC=C2C3=CC=CC4=CC=CC=C43)[Si](C)(C)C5=C([CH-]C6=C5C(=CC=C6)C7=CC=CC8=CC=CC=C87)CC(C)C.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C48H46Si.2ClH.Zr/c1-31(2)27-37-29-35-19-13-25-43(41-23-11-17-33-15-7-9-21-39(33)41)45(35)47(37)49(5,6)48-38(28-32(3)4)30-36-20-14-26-44(46(36)48)42-24-12-18-34-16-8-10-22-40(34)42;;;/h7-26,29-32H,27-28H2,1-6H3;2*1H;/q-2;;;+4/p-2