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

Systemtic Name: 3-butan-2-yl-2-[(3-butan-2-yl-1H-inden-1-id-2-yl)methyl]-1H-inden-1-ide; zirconium(4+); dichloride Openeye Name: 3-sec-butyl-2-[(3-sec-butyl-1H-inden-1-id-2-yl)methyl]-1H-inden-1-ide; zirconium(4+); dichloride CAS Name: 3-butan-2-yl-2-[(3-butan-2-yl-1H-inden-1-id-2-yl)methyl]-1H-inden-1-ide; zirconium(4+); dichloride IUPAC Name: 3-butan-2-yl-2-[(3-butan-2-yl-1H-inden-1-id-2-yl)methyl]-1H-inden-1-ide; zirconium(4+); dichloride Traditional Name: 3-sec-butyl-2-[(3-sec-butyl-1H-inden-1-id-2-yl)methyl]-1H-inden-1-ide; zirconium(4+); dichloride Formula: C27H30Cl2Zr MolecularWeight: 516.6571

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C([CH-]C2=CC=CC=C21)CC3=C(C4=CC=CC=C4[CH-]3)C(C)CC.[Cl-].[Cl-].[Zr+4]

Isomeric SMILES

CCC(C)C1=C([CH-]C2=CC=CC=C21)CC3=C(C4=CC=CC=C4[CH-]3)C(C)CC.[Cl-].[Cl-].[Zr+4]

InChI

InChI=1S/C27H30.2ClH.Zr/c1-5-18(3)26-22(15-20-11-7-9-13-24(20)26)17-23-16-21-12-8-10-14-25(21)27(23)19(4)6-2;;;/h7-16,18-19H,5-6,17H2,1-4H3;2*1H;/q-2;;;+4/p-2