carbon monoxide; iron(2+); [(2S,6S)-6-oxidanyl-6-phenyl-hexan-2-yl]oxymethanone

Systemtic Name: carbon monoxide; iron(2+); [(2S,6S)-6-oxidanyl-6-phenyl-hexan-2-yl]oxymethanone Openeye Name: ferrous; carbon monoxide; [(1S,5S)-5-hydroxy-1-methyl-5-phenyl-pentoxy]methanone CAS Name: carbon monoxide; [(2S,6S)-6-hydroxy-6-phenylhexan-2-yl]oxymethanone; iron(2+) IUPAC Name: carbon monoxide; [(2S,6S)-6-hydroxy-6-phenylhexan-2-yl]oxymethanone; iron(2+) Traditional Name: ferrous; carbon monoxide; [(1S,5S)-5-hydroxy-1-methyl-5-phenyl-pentoxy]methanone Formula: C16H14FeO6+ MolecularWeight: 358.12376

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O3.3CO.Fe/c1-11(16-10-14)6-5-9-13(15)12-7-3-2-4-8-12;3*1-2;/h2-9,11,13,15H,1H3;;;;/q-1;;;;+2/t11-,13-;;;;/m0..../s1