bis[7-(1,2-dihydroacenaphthylen-5-yl)-2-methyl-3H-inden-3-id-1-yl]-methyl-phenyl-silane; zirconium(4+); dichloride

Systemtic Name: bis[7-(1,2-dihydroacenaphthylen-5-yl)-2-methyl-3H-inden-3-id-1-yl]-methyl-phenyl-silane; zirconium(4+); dichloride Openeye Name: bis[7-(1,2-dihydroacenaphthylen-5-yl)-2-methyl-3H-inden-3-id-1-yl]-methyl-phenyl-silane; zirconium(4+); dichloride CAS Name: bis[7-(1,2-dihydroacenaphthylen-5-yl)-2-methyl-3H-inden-3-id-1-yl]-methyl-phenylsilane; zirconium(4+); dichloride IUPAC Name: bis[7-(1,2-dihydroacenaphthylen-5-yl)-2-methyl-3H-inden-3-id-1-yl]-methyl-phenylsilane; zirconium(4+); dichloride Traditional Name: bis(7-acenaphthen-5-yl-2-methyl-3H-inden-3-id-1-yl)-methyl-phenyl-silane; zirconium(4+); dichloride Formula: C51H40Cl2SiZr MolecularWeight: 843.0788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C([CH-]1)C=CC=C2C3=C4C=CC=C5C4=C(CC5)C=C3)[Si](C)(C6=CC=CC=C6)C7=C([CH-]C8=C7C(=CC=C8)C9=C1C=CC=C2C1=C(CC2)C=C9)C.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC1=C(C2=C([CH-]1)C=CC=C2C3=C4C=CC=C5C4=C(CC5)C=C3)[Si](C)(C6=CC=CC=C6)C7=C([CH-]C8=C7C(=CC=C8)C9=C1C=CC=C2C1=C(CC2)C=C9)C.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C51H40Si.2ClH.Zr/c1-31-29-37-13-9-19-44(40-27-25-35-23-21-33-11-7-17-42(40)46(33)35)48(37)50(31)52(3,39-15-5-4-6-16-39)51-32(2)30-38-14-10-20-45(49(38)51)41-28-26-36-24-22-34-12-8-18-43(41)47(34)36;;;/h4-20,25-30H,21-24H2,1-3H3;2*1H;/q-2;;;+4/p-2