bis(2-methyl-5-propan-2-yl-7-pyridin-1-id-2-ylidene-inden-1-yl)-diphenyl-silane; zirconium(4+); dichloride

Systemtic Name: bis(2-methyl-5-propan-2-yl-7-pyridin-1-id-2-ylidene-inden-1-yl)-diphenyl-silane; zirconium(4+); dichloride Openeye Name: bis(5-isopropyl-2-methyl-7-pyridin-1-id-2-ylidene-inden-1-yl)-diphenyl-silane; zirconium(4+); dichloride CAS Name: bis[2-methyl-5-propan-2-yl-7-(2-pyridin-1-idylidene)-1-indenyl]-diphenylsilane; zirconium(4+); dichloride IUPAC Name: bis(2-methyl-5-propan-2-yl-7-pyridin-1-id-2-ylideneinden-1-yl)-diphenylsilane; zirconium(4+); dichloride Traditional Name: bis(5-isopropyl-2-methyl-7-pyridin-1-id-2-ylidene-inden-1-yl)-diphenyl-silane; zirconium(4+); dichloride Formula: C48H44Cl2N2SiZr MolecularWeight: 839.09186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=CC(=C3C=CC=C[N-]3)C2=C1[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C6=C7C(=CC(=CC7=C8C=CC=C[N-]8)C(C)C)C=C6C)C(C)C.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CC1=CC2=CC(=CC(=C3C=CC=C[N-]3)C2=C1[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C6=C7C(=CC(=CC7=C8C=CC=C[N-]8)C(C)C)C=C6C)C(C)C.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C48H44N2Si.2ClH.Zr/c1-31(2)35-27-37-25-33(5)47(45(37)41(29-35)43-21-13-15-23-49-43)51(39-17-9-7-10-18-39,40-19-11-8-12-20-40)48-34(6)26-38-28-36(32(3)4)30-42(46(38)48)44-22-14-16-24-50-44;;;/h7-32H,1-6H3;2*1H;/q-2;;;+4/p-2