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

Systemtic Name: bis(2-ethyl-5,7-dipyridin-2-yl-3H-inden-3-id-1-yl)-dimethyl-silane; zirconium(4+); dichloride Openeye Name: bis[2-ethyl-5,7-bis(2-pyridyl)-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride CAS Name: bis[2-ethyl-5,7-bis(2-pyridinyl)-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(4+); dichloride IUPAC Name: bis(2-ethyl-5,7-dipyridin-2-yl-3H-inden-3-id-1-yl)-dimethylsilane; zirconium(4+); dichloride Traditional Name: bis[2-ethyl-5,7-bis(2-pyridyl)-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride Formula: C44H38Cl2N4SiZr MolecularWeight: 813.01482

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=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)CC.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CCC1=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)CC.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C44H38N4Si.2ClH.Zr/c1-5-29-23-33-25-31(37-15-7-11-19-45-37)27-35(39-17-9-13-21-47-39)41(33)43(29)49(3,4)44-30(6-2)24-34-26-32(38-16-8-12-20-46-38)28-36(42(34)44)40-18-10-14-22-48-40;;;/h7-28H,5-6H2,1-4H3;2*1H;/q-2;;;+4/p-2