carbon monoxide; iron(2+); 1-methoxy-4-phenyl-cyclohexane; hexafluorophosphate

Systemtic Name: carbon monoxide; iron(2+); 1-methoxy-4-phenyl-cyclohexane; hexafluorophosphate Openeye Name: ferrous; carbon monoxide; 1-methoxy-4-phenyl-cyclohexane; hexafluorophosphate CAS Name: carbon monoxide; iron(2+); 1-methoxy-4-phenylcyclohexane; hexafluorophosphate IUPAC Name: carbon monoxide; iron(2+); 1-methoxy-4-phenylcyclohexane; hexafluorophosphate Traditional Name: ferrous; carbon monoxide; 1-methoxy-4-phenyl-cyclohexane; hexafluorophosphate Formula: C16H13F6FeO4P+ MolecularWeight: 470.0812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CO[C]1[CH]C[C]([CH][CH]1)C2=CC=CC=C2.[C-]#[O+].[C-]#[O+].[C-]#[O+].F[P-](F)(F)(F)(F)F.[Fe+2]

Isomeric SMILES

CO[C]1[CH]C[C]([CH][CH]1)C2=CC=CC=C2.[C-]#[O+].[C-]#[O+].[C-]#[O+].F[P-](F)(F)(F)(F)F.[Fe+2]

InChI

InChI=1S/C13H13O.3CO.F6P.Fe/c1-14-13-9-7-12(8-10-13)11-5-3-2-4-6-11;3*1-2;1-7(2,3,4,5)6;/h2-7,9-10H,8H2,1H3;;;;;/q;;;;-1;+2