carbon monoxide; ethyl cyclohexanecarboxylate; iron; hexafluorophosphate

Systemtic Name: carbon monoxide; ethyl cyclohexanecarboxylate; iron; hexafluorophosphate Openeye Name: carbon monoxide; ethyl cyclohexanecarboxylate; iron; hexafluorophosphate CAS Name: carbon monoxide; cyclohexanecarboxylic acid ethyl ester; iron; hexafluorophosphate IUPAC Name: carbon monoxide; ethyl cyclohexanecarboxylate; iron; hexafluorophosphate Traditional Name: carbon monoxide; cyclohexanecarboxylic acid ethyl ester; iron; hexafluorophosphate Formula: C12H11F6FeO5P MolecularWeight: 436.02192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11O2.3CO.F6P.Fe/c1-2-11-9(10)8-6-4-3-5-7-8;3*1-2;1-7(2,3,4,5)6;/h3-6H,2,7H2,1H3;;;;;/q+1;;;;-1;