dimethyl-bis(2-methyl-3-phenanthren-4-yl-1H-inden-1-id-4-yl)silane; zirconium(4+); dichloride

Systemtic Name: dimethyl-bis(2-methyl-3-phenanthren-4-yl-1H-inden-1-id-4-yl)silane; zirconium(4+); dichloride Openeye Name: dimethyl-bis[2-methyl-3-(4-phenanthryl)-1H-inden-1-id-4-yl]silane; zirconium(4+); dichloride CAS Name: dimethyl-bis[2-methyl-3-(4-phenanthrenyl)-1H-inden-1-id-4-yl]silane; zirconium(4+); dichloride IUPAC Name: dimethyl-bis(2-methyl-3-phenanthren-4-yl-1H-inden-1-id-4-yl)silane; zirconium(4+); dichloride Traditional Name: dimethyl-bis[2-methyl-3-(4-phenanthryl)-1H-inden-1-id-4-yl]silane; zirconium(4+); dichloride Formula: C50H38Cl2SiZr MolecularWeight: 829.05222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C([CH-]1)C=CC=C2[Si](C)(C)C3=CC=CC4=C3C(=C([CH-]4)C)C5=CC=CC6=C5C7=CC=CC=C7C=C6)C8=CC=CC9=C8C1=CC=CC=C1C=C9.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC1=C(C2=C([CH-]1)C=CC=C2[Si](C)(C)C3=CC=CC4=C3C(=C([CH-]4)C)C5=CC=CC6=C5C7=CC=CC=C7C=C6)C8=CC=CC9=C8C1=CC=CC=C1C=C9.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C50H38Si.2ClH.Zr/c1-31-29-37-17-11-23-43(49(37)45(31)41-21-9-15-35-27-25-33-13-5-7-19-39(33)47(35)41)51(3,4)44-24-12-18-38-30-32(2)46(50(38)44)42-22-10-16-36-28-26-34-14-6-8-20-40(34)48(36)42;;;/h5-30H,1-4H3;2*1H;/q-2;;;+4/p-2