dimethyl-bis(2-phenyl-5,7-dipyridin-2-yl-3H-inden-3-id-1-yl)silane; zirconium(4+); dichloride

Systemtic Name: dimethyl-bis(2-phenyl-5,7-dipyridin-2-yl-3H-inden-3-id-1-yl)silane; zirconium(4+); dichloride Openeye Name: dimethyl-bis[2-phenyl-5,7-bis(2-pyridyl)-3H-inden-3-id-1-yl]silane; zirconium(4+); dichloride CAS Name: dimethyl-bis[2-phenyl-5,7-bis(2-pyridinyl)-3H-inden-3-id-1-yl]silane; zirconium(4+); dichloride IUPAC Name: dimethyl-bis(2-phenyl-5,7-dipyridin-2-yl-3H-inden-3-id-1-yl)silane; zirconium(4+); dichloride Traditional Name: dimethyl-bis[2-phenyl-5,7-bis(2-pyridyl)-3H-inden-3-id-1-yl]silane; zirconium(4+); dichloride Formula: C52H38Cl2N4SiZr MolecularWeight: 909.10042

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Descriptors Computed from Structure

Canonical SMILES:

C[Si](C)(C1=C([CH-]C2=CC(=CC(=C21)C3=CC=CC=N3)C4=CC=CC=N4)C5=CC=CC=C5)C6=C([CH-]C7=CC(=CC(=C76)C8=CC=CC=N8)C9=CC=CC=N9)C1=CC=CC=C1.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

C[Si](C)(C1=C([CH-]C2=CC(=CC(=C21)C3=CC=CC=N3)C4=CC=CC=N4)C5=CC=CC=C5)C6=C([CH-]C7=CC(=CC(=C76)C8=CC=CC=N8)C9=CC=CC=N9)C1=CC=CC=C1.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C52H38N4Si.2ClH.Zr/c1-57(2,51-41(35-17-5-3-6-18-35)33-39-29-37(45-21-9-13-25-53-45)31-43(49(39)51)47-23-11-15-27-55-47)52-42(36-19-7-4-8-20-36)34-40-30-38(46-22-10-14-26-54-46)32-44(50(40)52)48-24-12-16-28-56-48;;;/h3-34H,1-2H3;2*1H;/q-2;;;+4/p-2