2-butan-2-yl-3-[2-(2-butan-2-yl-7-phenyl-3H-inden-3-id-1-yl)ethyl]-4-phenyl-1H-inden-1-ide; zirconium(4+); dichloride

Systemtic Name: 2-butan-2-yl-3-[2-(2-butan-2-yl-7-phenyl-3H-inden-3-id-1-yl)ethyl]-4-phenyl-1H-inden-1-ide; zirconium(4+); dichloride Openeye Name: 4-phenyl-3-[2-(7-phenyl-2-sec-butyl-3H-inden-3-id-1-yl)ethyl]-2-sec-butyl-1H-inden-1-ide; zirconium(4+); dichloride CAS Name: 2-butan-2-yl-3-[2-(2-butan-2-yl-7-phenyl-3H-inden-3-id-1-yl)ethyl]-4-phenyl-1H-inden-1-ide; zirconium(4+); dichloride IUPAC Name: 2-butan-2-yl-3-[2-(2-butan-2-yl-7-phenyl-3H-inden-3-id-1-yl)ethyl]-4-phenyl-1H-inden-1-ide; zirconium(4+); dichloride Traditional Name: 4-phenyl-3-[2-(7-phenyl-2-sec-butyl-3H-inden-3-id-1-yl)ethyl]-2-sec-butyl-1H-inden-1-ide; zirconium(4+); dichloride Formula: C40H40Cl2Zr MolecularWeight: 682.8756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(C2=C([CH-]1)C=CC=C2C3=CC=CC=C3)CCC4=C([CH-]C5=C4C(=CC=C5)C6=CC=CC=C6)C(C)CC.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CCC(C)C1=C(C2=C([CH-]1)C=CC=C2C3=CC=CC=C3)CCC4=C([CH-]C5=C4C(=CC=C5)C6=CC=CC=C6)C(C)CC.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C40H40.2ClH.Zr/c1-5-27(3)37-25-31-19-13-21-33(29-15-9-7-10-16-29)39(31)35(37)23-24-36-38(28(4)6-2)26-32-20-14-22-34(40(32)36)30-17-11-8-12-18-30;;;/h7-22,25-28H,5-6,23-24H2,1-4H3;2*1H;/q-2;;;+4/p-2