carbon monoxide; cyclohexa-2,5-dien-1-ylidene(methyl)oxidanium; iron; tetrafluoroborate

Systemtic Name: carbon monoxide; cyclohexa-2,5-dien-1-ylidene(methyl)oxidanium; iron; tetrafluoroborate Openeye Name: carbon monoxide; cyclohexa-2,5-dien-1-ylidene(methyl)oxonium; iron; tetrafluoroborate CAS Name: carbon monoxide; 1-cyclohexa-2,5-dienylidene(methyl)oxonium; iron; tetrafluoroborate IUPAC Name: carbon monoxide; cyclohexa-2,5-dien-1-ylidene(methyl)oxidanium; iron; tetrafluoroborate Traditional Name: carbon monoxide; cyclohexa-2,5-dien-1-ylidene(methyl)oxonium; iron; tetrafluoroborate Formula: C10H9BF4FeO4 MolecularWeight: 335.825673

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.C[O+]=C1C=CCC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

Isomeric SMILES

[B-](F)(F)(F)F.C[O+]=C1C=CCC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe]

InChI

InChI=1S/C7H9O.3CO.BF4.Fe/c1-8-7-5-3-2-4-6-7;3*1-2;2-1(3,4)5;/h3-6H,2H2,1H3;;;;;/q+1;;;;-1;