(diphenylmethylidene)zirconium(2+); 2-hexyl-1H-inden-1-ide; dichloride

Systemtic Name: (diphenylmethylidene)zirconium(2+); 2-hexyl-1H-inden-1-ide; dichloride Openeye Name: benzhydrylidenezirconium(2+); 2-hexyl-1H-inden-1-ide; dichloride CAS Name: (diphenylmethylene)zirconium(2+); 2-hexyl-1H-inden-1-ide; dichloride IUPAC Name: benzhydrylidenezirconium(2+); 2-hexyl-1H-inden-1-ide; dichloride Traditional Name: benzhydrylidenezirconium(2+); 2-hexyl-1H-inden-1-ide; dichloride Formula: C86H96Cl2Zr2-2 MolecularWeight: 1383.03644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC2=CC=CC=C2[CH-]1.CCCCCCC1=CC2=CC=CC=C2[CH-]1.CCCCCCC1=CC2=CC=CC=C2[CH-]1.CCCCCCC1=CC2=CC=CC=C2[CH-]1.C1=CC=C(C=C1)C(=[Zr+2])C2=CC=CC=C2.C1=CC=C(C=C1)C(=[Zr+2])C2=CC=CC=C2.[Cl-].[Cl-]

Isomeric SMILES

CCCCCCC1=CC2=CC=CC=C2[CH-]1.CCCCCCC1=CC2=CC=CC=C2[CH-]1.CCCCCCC1=CC2=CC=CC=C2[CH-]1.CCCCCCC1=CC2=CC=CC=C2[CH-]1.C1=CC=C(C=C1)C(=[Zr+2])C2=CC=CC=C2.C1=CC=C(C=C1)C(=[Zr+2])C2=CC=CC=C2.[Cl-].[Cl-]

InChI

InChI=1S/4C15H19.2C13H10.2ClH.2Zr/c4*1-2-3-4-5-8-13-11-14-9-6-7-10-15(14)12-13;2*1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;;;;/h4*6-7,9-12H,2-5,8H2,1H3;2*1-10H;2*1H;;/q4*-1;;;;;2*+2/p-2