carbon monoxide; iron; triethylazanium

Systemtic Name: carbon monoxide; iron; triethylazanium Openeye Name: carbon monoxide; iron; triethylammonium CAS Name: carbon monoxide; iron; triethylammonium IUPAC Name: carbon monoxide; iron; triethylazanium Traditional Name: carbon monoxide; iron; triethylammonium Formula: C17H16Fe3NO11+ MolecularWeight: 577.84404

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe].[Fe]

Isomeric SMILES

CC[NH+](CC)CC.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Fe].[Fe].[Fe]

InChI

InChI=1S/C6H15N.11CO.3Fe/c1-4-7(5-2)6-3;11*1-2;;;/h4-6H2,1-3H3;;;;;;;;;;;;;;/p+1