bis(2-methyl-7-quinolin-3-yl-inden-2-id-1-yl)-diphenyl-silane; zirconium(4+); dichloride

Systemtic Name: bis(2-methyl-7-quinolin-3-yl-inden-2-id-1-yl)-diphenyl-silane; zirconium(4+); dichloride Openeye Name: bis[2-methyl-7-(3-quinolyl)inden-2-id-1-yl]-diphenyl-silane; zirconium(4+); dichloride CAS Name: bis[2-methyl-7-(3-quinolinyl)-1-inden-2-idyl]-diphenylsilane; zirconium(4+); dichloride IUPAC Name: bis(2-methyl-7-quinolin-3-ylinden-2-id-1-yl)-diphenylsilane; zirconium(4+); dichloride Traditional Name: bis[2-methyl-7-(3-quinolyl)inden-2-id-1-yl]-diphenyl-silane; zirconium(4+); dichloride Formula: C50H36Cl2N2SiZr MolecularWeight: 855.04974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[C-]1C=C2C=CC=C(C2=C1[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C5=C6C(=C[C-]5C)C=CC=C6C7=CC8=CC=CC=C8N=C7)C9=CC1=CC=CC=C1N=C9.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

C[C-]1C=C2C=CC=C(C2=C1[Si](C3=CC=CC=C3)(C4=CC=CC=C4)C5=C6C(=C[C-]5C)C=CC=C6C7=CC8=CC=CC=C8N=C7)C9=CC1=CC=CC=C1N=C9.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C50H36N2Si.2ClH.Zr/c1-33-27-37-17-13-23-43(39-29-35-15-9-11-25-45(35)51-31-39)47(37)49(33)53(41-19-5-3-6-20-41,42-21-7-4-8-22-42)50-34(2)28-38-18-14-24-44(48(38)50)40-30-36-16-10-12-26-46(36)52-32-40;;;/h3-32H,1-2H3;2*1H;/q-2;;;+4/p-2