carbon monoxide; cyclopentane; iron(2+); 1-phenylethanone

Systemtic Name: carbon monoxide; cyclopentane; iron(2+); 1-phenylethanone Openeye Name: ferrous; carbon monoxide; cyclopentane; 1-phenylethanone CAS Name: carbon monoxide; cyclopentane; iron(2+); 1-phenylethanone IUPAC Name: carbon monoxide; cyclopentane; iron(2+); 1-phenylethanone Traditional Name: ferrous; carbon monoxide; cyclopentane; 1-phenylethanone Formula: C15H12FeO3+ MolecularWeight: 296.09898

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=[C-]C=C1.[C-]#[O+].[C-]#[O+].[CH]1[CH][CH][CH][CH]1.[Fe+2]

Isomeric SMILES

CC(=O)C1=CC=[C-]C=C1.[C-]#[O+].[C-]#[O+].[CH]1[CH][CH][CH][CH]1.[Fe+2]

InChI

InChI=1S/C8H7O.C5H5.2CO.Fe/c1-7(9)8-5-3-2-4-6-8;1-2-4-5-3-1;2*1-2;/h3-6H,1H3;1-5H;;;/q-1;;;;+2