carbon monoxide; iron(2+); methyl hexanoate; hexafluorophosphate

Systemtic Name: carbon monoxide; iron(2+); methyl hexanoate; hexafluorophosphate Openeye Name: ferrous; carbon monoxide; methyl hexanoate; hexafluorophosphate CAS Name: carbon monoxide; hexanoic acid methyl ester; iron(2+); hexafluorophosphate IUPAC Name: carbon monoxide; iron(2+); methyl hexanoate; hexafluorophosphate Traditional Name: ferrous; carbon monoxide; hexanoic acid methyl ester; hexafluorophosphate Formula: C10H9F6FeO5P+ MolecularWeight: 409.98464

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)[CH][CH][CH][CH][CH2].[C-]#[O+].[C-]#[O+].[C-]#[O+].F[P-](F)(F)(F)(F)F.[Fe+2]

Isomeric SMILES

COC(=O)[CH][CH][CH][CH][CH2].[C-]#[O+].[C-]#[O+].[C-]#[O+].F[P-](F)(F)(F)(F)F.[Fe+2]

InChI

InChI=1S/C7H9O2.3CO.F6P.Fe/c1-3-4-5-6-7(8)9-2;3*1-2;1-7(2,3,4,5)6;/h3-6H,1H2,2H3;;;;;/q;;;;-1;+2