cyclopenta-1,3-diene; oxolane; tris(fluoranyl)methanesulfonate; zirconium(4+)

Systemtic Name: cyclopenta-1,3-diene; oxolane; tris(fluoranyl)methanesulfonate; zirconium(4+) Openeye Name: cyclopenta-1,3-diene; tetrahydrofuran; trifluoromethanesulfonate; zirconium(4+) CAS Name: cyclopenta-1,3-diene; oxolane; trifluoromethanesulfonate; zirconium(4+) IUPAC Name: cyclopenta-1,3-diene; oxolane; trifluoromethanesulfonate; zirconium(4+) Traditional Name: cyclopenta-1,3-diene; tetrahydrofuran; zirconium(4+); ditriflate Formula: C16H18F6O7S2Zr MolecularWeight: 591.654339

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Zr+4]

Isomeric SMILES

C1CCOC1.[CH-]1C=CC=C1.[CH-]1C=CC=C1.C(F)(F)(F)S(=O)(=O)[O-].C(F)(F)(F)S(=O)(=O)[O-].[Zr+4]

InChI

InChI=1S/2C5H5.C4H8O.2CHF3O3S.Zr/c3*1-2-4-5-3-1;2*2-1(3,4)8(5,6)7;/h2*1-5H;1-4H2;2*(H,5,6,7);/q2*-1;;;;+4/p-2