bis(2-butyl-7-quinolin-3-yl-3H-inden-3-id-1-yl)-dimethyl-silane; zirconium(4+); dichloride

Systemtic Name: bis(2-butyl-7-quinolin-3-yl-3H-inden-3-id-1-yl)-dimethyl-silane; zirconium(4+); dichloride Openeye Name: bis[2-butyl-7-(3-quinolyl)-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride CAS Name: bis[2-butyl-7-(3-quinolinyl)-3H-inden-3-id-1-yl]-dimethylsilane; zirconium(4+); dichloride IUPAC Name: bis(2-butyl-7-quinolin-3-yl-3H-inden-3-id-1-yl)-dimethylsilane; zirconium(4+); dichloride Traditional Name: bis[2-butyl-7-(3-quinolyl)-3H-inden-3-id-1-yl]-dimethyl-silane; zirconium(4+); dichloride Formula: C46H44Cl2N2SiZr MolecularWeight: 815.07046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=C([CH-]1)C=CC=C2C3=CC4=CC=CC=C4N=C3)[Si](C)(C)C5=C([CH-]C6=C5C(=CC=C6)C7=CC8=CC=CC=C8N=C7)CCCC.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CCCCC1=C(C2=C([CH-]1)C=CC=C2C3=CC4=CC=CC=C4N=C3)[Si](C)(C)C5=C([CH-]C6=C5C(=CC=C6)C7=CC8=CC=CC=C8N=C7)CCCC.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C46H44N2Si.2ClH.Zr/c1-5-7-15-35-27-33-19-13-21-39(37-25-31-17-9-11-23-41(31)47-29-37)43(33)45(35)49(3,4)46-36(16-8-6-2)28-34-20-14-22-40(44(34)46)38-26-32-18-10-12-24-42(32)48-30-38;;;/h9-14,17-30H,5-8,15-16H2,1-4H3;2*1H;/q-2;;;+4/p-2