carbon monoxide; cyclopentane; iron; 1-methylazulene; hexafluorophosphate

Systemtic Name: carbon monoxide; cyclopentane; iron; 1-methylazulene; hexafluorophosphate Openeye Name: carbon monoxide; cyclopentane; iron; 1-methylazulene; hexafluorophosphate CAS Name: carbon monoxide; cyclopentane; iron; 1-methylazulene; hexafluorophosphate IUPAC Name: carbon monoxide; cyclopentane; iron; 1-methylazulene; hexafluorophosphate Traditional Name: carbon monoxide; cyclopentane; iron; 1-methylazulene; hexafluorophosphate Formula: C21H11F6Fe2O5P- MolecularWeight: 599.96322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H6.C5H5.5CO.F6P.2Fe/c1-9-7-8-10-5-3-2-4-6-11(9)10;1-2-4-5-3-1;5*1-2;1-7(2,3,4,5)6;;/h5,7-8H,1H3;1-5H;;;;;;;;/q;;;;;;;-1;;