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

Systemtic Name: 2-propylcyclopenta-1,3-diene; tris(fluoranyl)methanesulfonate; zirconium(2+) Openeye Name: 2-propylcyclopenta-1,3-diene; trifluoromethanesulfonate; zirconium(2+) CAS Name: 2-propylcyclopenta-1,3-diene; trifluoromethanesulfonate; zirconium(2+) IUPAC Name: 2-propylcyclopenta-1,3-diene; trifluoromethanesulfonate; zirconium(2+) Traditional Name: 2-propylcyclopenta-1,3-diene; zirconium(2+); ditriflate Formula: C18H22F6O6S2Zr-2 MolecularWeight: 603.708099

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=[C-]CC=C1.CCCC1=[C-]CC=C1.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Zr+2]

Isomeric SMILES

CCCC1=[C-]CC=C1.CCCC1=[C-]CC=C1.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Zr+2]

InChI

InChI=1S/2C8H11.2CHF3O3S.Zr/c2*1-2-5-8-6-3-4-7-8;2*2-1(3,4)8(5,6)7;/h2*3,6H,2,4-5H2,1H3;2*(H,5,6,7);/q2*-1;;;+2/p-2