2-octadecylcyclopenta-1,3-diene; zirconium(2+); dichloride

Systemtic Name: 2-octadecylcyclopenta-1,3-diene; zirconium(2+); dichloride Openeye Name: 2-octadecylcyclopenta-1,3-diene; zirconium(2+); dichloride CAS Name: 2-octadecylcyclopenta-1,3-diene; zirconium(2+); dichloride IUPAC Name: 2-octadecylcyclopenta-1,3-diene; zirconium(2+); dichloride Traditional Name: 2-stearylcyclopenta-1,3-diene; zirconium(2+); dichloride Formula: C92H164Cl2Zr2-2 MolecularWeight: 1523.64056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1=[C-]CC=C1.CCCCCCCCCCCCCCCCCCC1=[C-]CC=C1.CCCCCCCCCCCCCCCCCCC1=[C-]CC=C1.CCCCCCCCCCCCCCCCCCC1=[C-]CC=C1.[Cl-].[Cl-].[Zr+2].[Zr+2]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1=[C-]CC=C1.CCCCCCCCCCCCCCCCCCC1=[C-]CC=C1.CCCCCCCCCCCCCCCCCCC1=[C-]CC=C1.CCCCCCCCCCCCCCCCCCC1=[C-]CC=C1.[Cl-].[Cl-].[Zr+2].[Zr+2]

InChI

InChI=1S/4C23H41.2ClH.2Zr/c4*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-21-18-19-22-23;;;;/h4*18,21H,2-17,19-20H2,1H3;2*1H;;/q4*-1;;;2*+2/p-2