1-(2-cyclohexylphenyl)inden-1-ide; propan-2-ylidenezirconium(2+); dichloride

Systemtic Name: 1-(2-cyclohexylphenyl)inden-1-ide; propan-2-ylidenezirconium(2+); dichloride Openeye Name: 1-(2-cyclohexylphenyl)inden-1-ide; isopropylidenezirconium(2+); dichloride CAS Name: 1-(2-cyclohexylphenyl)inden-1-ide; propan-2-ylidenezirconium(2+); dichloride IUPAC Name: 1-(2-cyclohexylphenyl)inden-1-ide; propan-2-ylidenezirconium(2+); dichloride Traditional Name: 1-(2-cyclohexylphenyl)inden-1-ide; isopropylidenezirconium(2+); dichloride Formula: C45H48Cl2Zr-2 MolecularWeight: 750.99262

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Descriptors Computed from Structure

Canonical SMILES:

CC(=[Zr+2])C.C1CCC(CC1)C2=CC=CC=C2[C-]3C=CC4=CC=CC=C34.C1CCC(CC1)C2=CC=CC=C2[C-]3C=CC4=CC=CC=C34.[Cl-].[Cl-]

Isomeric SMILES

CC(=[Zr+2])C.C1CCC(CC1)C2=CC=CC=C2[C-]3C=CC4=CC=CC=C34.C1CCC(CC1)C2=CC=CC=C2[C-]3C=CC4=CC=CC=C34.[Cl-].[Cl-]

InChI

InChI=1S/2C21H21.C3H6.2ClH.Zr/c2*1-2-8-16(9-3-1)18-12-6-7-13-20(18)21-15-14-17-10-4-5-11-19(17)21;1-3-2;;;/h2*4-7,10-16H,1-3,8-9H2;1-2H3;2*1H;/q2*-1;;;;+2/p-2