(E)-but-2-ene; carbon monoxide; iron; iron(2+); methanone

Systemtic Name: (E)-but-2-ene; carbon monoxide; iron; iron(2+); methanone Openeye Name: ferrous; (E)-but-2-ene; carbon monoxide; iron; methanone CAS Name: (E)-2-butene; carbon monoxide; iron; iron(2+); methanone IUPAC Name: (E)-but-2-ene; carbon monoxide; iron; iron(2+); methanone Traditional Name: ferrous; (E)-but-2-ene; carbon monoxide; iron; methanone Formula: C14H18Fe2O6 MolecularWeight: 393.97912

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC.CC=CC.[CH-]=O.[CH-]=O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe+2]

Isomeric SMILES

C/C=C/C.C/C=C/C.[CH-]=O.[CH-]=O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe+2]

InChI

InChI=1S/2C4H8.2CHO.4CO.2Fe/c2*1-3-4-2;6*1-2;;/h2*3-4H,1-2H3;2*1H;;;;;;/q;;2*-1;;;;;;+2/b2*4-3+;;;;;;;;