2-ethylcyclopenta-1,3-diene; tris(fluoranyl)methanesulfonate; zirconium(2+)

Systemtic Name: 2-ethylcyclopenta-1,3-diene; tris(fluoranyl)methanesulfonate; zirconium(2+) Openeye Name: 2-ethylcyclopenta-1,3-diene; trifluoromethanesulfonate; zirconium(2+) CAS Name: 2-ethylcyclopenta-1,3-diene; trifluoromethanesulfonate; zirconium(2+) IUPAC Name: 2-ethylcyclopenta-1,3-diene; trifluoromethanesulfonate; zirconium(2+) Traditional Name: 2-ethylcyclopenta-1,3-diene; zirconium(2+); ditriflate Formula: C16H18F6O6S2Zr-2 MolecularWeight: 575.654939

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=[C-]CC=C1.CCC1=[C-]CC=C1.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Zr+2]

Isomeric SMILES

CCC1=[C-]CC=C1.CCC1=[C-]CC=C1.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Zr+2]

InChI

InChI=1S/2C7H9.2CHF3O3S.Zr/c2*1-2-7-5-3-4-6-7;2*2-1(3,4)8(5,6)7;/h2*3,5H,2,4H2,1H3;2*(H,5,6,7);/q2*-1;;;+2/p-2