carbon monoxide; cyclopentane; iron(2+); [(1S)-1-isocyanoethyl]benzene; hexafluorophosphate

Systemtic Name: carbon monoxide; cyclopentane; iron(2+); [(1S)-1-isocyanoethyl]benzene; hexafluorophosphate Openeye Name: ferrous; carbon monoxide; cyclopentane; [(1S)-1-isocyanoethyl]benzene; hexafluorophosphate CAS Name: carbon monoxide; cyclopentane; iron(2+); [(1S)-1-isocyanoethyl]benzene; hexafluorophosphate IUPAC Name: carbon monoxide; cyclopentane; iron(2+); [(1S)-1-isocyanoethyl]benzene; hexafluorophosphate Traditional Name: ferrous; carbon monoxide; cyclopentane; [(1S)-1-isocyanoethyl]benzene; hexafluorophosphate Formula: C16H14F6FeNO2P+ MolecularWeight: 453.09704

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)[N+]#[C-].[C-]#[O+].[C-]#[O+].[CH]1[CH][CH][CH][CH]1.F[P-](F)(F)(F)(F)F.[Fe+2]

InChI

InChI=1S/C9H9N.C5H5.2CO.F6P.Fe/c1-8(10-2)9-6-4-3-5-7-9;1-2-4-5-3-1;2*1-2;1-7(2,3,4,5)6;/h3-8H,1H3;1-5H;;;;/q;;;;-1;+2/t8-;;;;;/m0...../s1