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

Systemtic Name: bis(2,4-dimethyl-7-pyridin-2-yl-3H-inden-3-id-1-yl)-diphenyl-silane; zirconium(4+); dichloride Openeye Name: bis[2,4-dimethyl-7-(2-pyridyl)-3H-inden-3-id-1-yl]-diphenyl-silane; zirconium(4+); dichloride CAS Name: bis[2,4-dimethyl-7-(2-pyridinyl)-3H-inden-3-id-1-yl]-diphenylsilane; zirconium(4+); dichloride IUPAC Name: bis(2,4-dimethyl-7-pyridin-2-yl-3H-inden-3-id-1-yl)-diphenylsilane; zirconium(4+); dichloride Traditional Name: bis[2,4-dimethyl-7-(2-pyridyl)-3H-inden-3-id-1-yl]-diphenyl-silane; zirconium(4+); dichloride Formula: C44H36Cl2N2SiZr MolecularWeight: 782.98554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=CC(=C2[CH-]1)C)C3=CC=CC=N3)[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C6=C([CH-]C7=C(C=CC(=C76)C8=CC=CC=N8)C)C.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC1=C(C2=C(C=CC(=C2[CH-]1)C)C3=CC=CC=N3)[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C6=C([CH-]C7=C(C=CC(=C76)C8=CC=CC=N8)C)C.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C44H36N2Si.2ClH.Zr/c1-29-21-23-35(39-19-11-13-25-45-39)41-37(29)27-31(3)43(41)47(33-15-7-5-8-16-33,34-17-9-6-10-18-34)44-32(4)28-38-30(2)22-24-36(42(38)44)40-20-12-14-26-46-40;;;/h5-28H,1-4H3;2*1H;/q-2;;;+4/p-2