butan-2-ylbenzene; carbon monoxide; iron; iron(2+)

Systemtic Name: butan-2-ylbenzene; carbon monoxide; iron; iron(2+) Openeye Name: ferrous; carbon monoxide; iron; 1-methylpropylbenzene CAS Name: butan-2-ylbenzene; carbon monoxide; iron; iron(2+) IUPAC Name: butan-2-ylbenzene; carbon monoxide; iron; iron(2+) Traditional Name: ferrous; carbon monoxide; iron; 1-methylpropylbenzene Formula: C16H13Fe2O6+ MolecularWeight: 412.96082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C[CH2-])C1=CC=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe+2]

Isomeric SMILES

CC(C[CH2-])C1=CC=CC=C1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe+2]

InChI

InChI=1S/C10H13.6CO.2Fe/c1-3-9(2)10-7-5-4-6-8-10;6*1-2;;/h4-9H,1,3H2,2H3;;;;;;;;/q-1;;;;;;;;+2