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

Systemtic Name: dimethyl-bis(2-methyl-5,7-dipyridin-2-yl-3H-inden-3-id-1-yl)silane; zirconium(4+); dichloride Openeye Name: dimethyl-bis[2-methyl-5,7-bis(2-pyridyl)-3H-inden-3-id-1-yl]silane; zirconium(4+); dichloride CAS Name: dimethyl-bis[2-methyl-5,7-bis(2-pyridinyl)-3H-inden-3-id-1-yl]silane; zirconium(4+); dichloride IUPAC Name: dimethyl-bis(2-methyl-5,7-dipyridin-2-yl-3H-inden-3-id-1-yl)silane; zirconium(4+); dichloride Traditional Name: dimethyl-bis[2-methyl-5,7-bis(2-pyridyl)-3H-inden-3-id-1-yl]silane; zirconium(4+); dichloride Formula: C42H34Cl2N4SiZr MolecularWeight: 784.96166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C(C=C2[CH-]1)C3=CC=CC=N3)C4=CC=CC=N4)[Si](C)(C)C5=C([CH-]C6=CC(=CC(=C65)C7=CC=CC=N7)C8=CC=CC=N8)C.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC1=C(C2=C(C=C(C=C2[CH-]1)C3=CC=CC=N3)C4=CC=CC=N4)[Si](C)(C)C5=C([CH-]C6=CC(=CC(=C65)C7=CC=CC=N7)C8=CC=CC=N8)C.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C42H34N4Si.2ClH.Zr/c1-27-21-31-23-29(35-13-5-9-17-43-35)25-33(37-15-7-11-19-45-37)39(31)41(27)47(3,4)42-28(2)22-32-24-30(36-14-6-10-18-44-36)26-34(40(32)42)38-16-8-12-20-46-38;;;/h5-26H,1-4H3;2*1H;/q-2;;;+4/p-2