carbon monoxide; cyclopentane; dimethanidylideneazanium; iron; iron(2+); methanone; chloride

Systemtic Name: carbon monoxide; cyclopentane; dimethanidylideneazanium; iron; iron(2+); methanone; chloride Openeye Name: diferrous; carbon monoxide; cyclopentane; dimethanidylideneammonium; iron; methanone; chloride CAS Name: carbon monoxide; cyclopentane; dimethanidylideneammonium; iron; iron(2+); methanone; chloride IUPAC Name: carbon monoxide; cyclopentane; dimethanidylideneazanium; iron; iron(2+); methanone; chloride Traditional Name: diferrous; carbon monoxide; cyclopentane; dimethanidylideneammonium; iron; methanone; chloride Formula: C28H24ClFe4NO6 MolecularWeight: 729.32626

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Descriptors Computed from Structure

Canonical SMILES:

[CH-]=[N+]=[CH-].[CH-]=O.[CH-]=O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Cl-].[Fe].[Fe].[Fe+2].[Fe+2]

Isomeric SMILES

[CH-]=[N+]=[CH-].[CH-]=O.[CH-]=O.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Cl-].[Fe].[Fe].[Fe+2].[Fe+2]

InChI

InChI=1S/4C5H5.C2H2N.2CHO.4CO.ClH.4Fe/c4*1-2-4-5-3-1;1-3-2;6*1-2;;;;;/h4*1-5H;1-2H;2*1H;;;;;1H;;;;/q;;;;3*-1;;;;;;;;2*+2/p-1