cyclopentane; 5-ethyl-2-nitro-cyclohexane-1-carbonitrile; iron(3+); hexafluorophosphate

Systemtic Name: cyclopentane; 5-ethyl-2-nitro-cyclohexane-1-carbonitrile; iron(3+); hexafluorophosphate Openeye Name: ferric; cyclopentane; 5-ethyl-2-nitro-cyclohexanecarbonitrile; hexafluorophosphate CAS Name: cyclopentane; 5-ethyl-2-nitro-1-cyclohexanecarbonitrile; iron(3+); hexafluorophosphate IUPAC Name: cyclopentane; 5-ethyl-2-nitrocyclohexane-1-carbonitrile; iron(3+); hexafluorophosphate Traditional Name: ferric; cyclopentane; 5-ethyl-2-nitro-cyclohexanecarbonitrile; hexafluorophosphate Formula: C14H14F6FeN2O2P+2 MolecularWeight: 443.08234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[C]1[CH][CH][C](C([CH]1)C#N)[N+](=O)[O-].[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.[Fe+3]

Isomeric SMILES

CC[C]1[CH][CH][C](C([CH]1)C#N)[N+](=O)[O-].[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.[Fe+3]

InChI

InChI=1S/C9H9N2O2.C5H5.F6P.Fe/c1-2-7-3-4-9(11(12)13)8(5-7)6-10;1-2-4-5-3-1;1-7(2,3,4,5)6;/h3-5,8H,2H2,1H3;1-5H;;/q;;-1;+3