2-butylcyclopenta-1,3-diene; zirconium(2+); trifluoride

Systemtic Name: 2-butylcyclopenta-1,3-diene; zirconium(2+); trifluoride Openeye Name: 2-butylcyclopenta-1,3-diene; zirconium(2+); trifluoride CAS Name: 2-butylcyclopenta-1,3-diene; zirconium(2+); trifluoride IUPAC Name: 2-butylcyclopenta-1,3-diene; zirconium(2+); trifluoride Traditional Name: 2-butylcyclopenta-1,3-diene; zirconium(2+); trifluoride Formula: C27H39F3Zr3 MolecularWeight: 694.26577

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.[F-].[F-].[F-].[Zr+2].[Zr+2].[Zr+2]

Isomeric SMILES

CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.CCCCC1=[C-]CC=C1.[F-].[F-].[F-].[Zr+2].[Zr+2].[Zr+2]

InChI

InChI=1S/3C9H13.3FH.3Zr/c3*1-2-3-6-9-7-4-5-8-9;;;;;;/h3*4,7H,2-3,5-6H2,1H3;3*1H;;;/q3*-1;;;;3*+2/p-3