carbon monoxide; cyclohexa-1,3-diene; iron(2+); tetrafluoroborate

Systemtic Name: carbon monoxide; cyclohexa-1,3-diene; iron(2+); tetrafluoroborate Openeye Name: ferrous; carbon monoxide; cyclohexa-1,3-diene; tetrafluoroborate CAS Name: carbon monoxide; cyclohexa-1,3-diene; iron(2+); tetrafluoroborate IUPAC Name: carbon monoxide; cyclohexa-1,3-diene; iron(2+); tetrafluoroborate Traditional Name: ferrous; carbon monoxide; cyclohexa-1,3-diene; tetrafluoroborate Formula: C9H7BF4FeO3 MolecularWeight: 305.799693

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Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.[C-]#[O+].[C-]#[O+].[C-]#[O+].C1[CH-]C=CC=C1.[Fe+2]

Isomeric SMILES

[B-](F)(F)(F)F.[C-]#[O+].[C-]#[O+].[C-]#[O+].C1[CH-]C=CC=C1.[Fe+2]

InChI

InChI=1S/C6H7.3CO.BF4.Fe/c1-2-4-6-5-3-1;3*1-2;2-1(3,4)5;/h1-5H,6H2;;;;;/q-1;;;;-1;+2