bis[(5Z)-2-butyl-5-pyridin-1-id-2-ylidene-7-pyridin-2-yl-inden-1-yl]-dimethyl-silane; zirconium(4+); dichloride

Systemtic Name: bis[(5Z)-2-butyl-5-pyridin-1-id-2-ylidene-7-pyridin-2-yl-inden-1-yl]-dimethyl-silane; zirconium(4+); dichloride Openeye Name: bis[(5Z)-2-butyl-5-pyridin-1-id-2-ylidene-7-(2-pyridyl)inden-1-yl]-dimethyl-silane; zirconium(4+); dichloride CAS Name: bis[(5Z)-2-butyl-5-(2-pyridin-1-idylidene)-7-(2-pyridinyl)-1-indenyl]-dimethylsilane; zirconium(4+); dichloride IUPAC Name: bis[(5Z)-2-butyl-5-pyridin-1-id-2-ylidene-7-pyridin-2-ylinden-1-yl]-dimethylsilane; zirconium(4+); dichloride Traditional Name: bis[(5Z)-2-butyl-5-pyridin-1-id-2-ylidene-7-(2-pyridyl)inden-1-yl]-dimethyl-silane; zirconium(4+); dichloride Formula: C48H46Cl2N4SiZr MolecularWeight: 869.12114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=CC(=C3C=CC=C[N-]3)C=C(C2=C1[Si](C)(C)C4=C5C(=CC(=C6C=CC=C[N-]6)C=C5C7=CC=CC=N7)C=C4CCCC)C8=CC=CC=N8.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CCCCC1=CC2=C/C(=C\3/[N-]C=CC=C3)/C=C(C2=C1[Si](C4=C5C(=C/C(=C/6\[N-]C=CC=C6)/C=C5C=C4CCCC)C7=CC=CC=N7)(C)C)C8=CC=CC=N8.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C48H46N4Si.2ClH.Zr/c1-5-7-17-33-27-37-29-35(41-19-9-13-23-49-41)31-39(43-21-11-15-25-51-43)45(37)47(33)53(3,4)48-34(18-8-6-2)28-38-30-36(42-20-10-14-24-50-42)32-40(46(38)48)44-22-12-16-26-52-44;;;/h9-16,19-32H,5-8,17-18H2,1-4H3;2*1H;/q-2;;;+4/p-2/b41-35-,42-36-;;;