carbon monoxide; iron; propan-2-ylbismuth; tetraethylazanium

Systemtic Name: carbon monoxide; iron; propan-2-ylbismuth; tetraethylazanium Openeye Name: carbon monoxide; iron; isopropylbismuth; tetraethylammonium CAS Name: carbon monoxide; iron; propan-2-ylbismuth; tetraethylammonium IUPAC Name: carbon monoxide; iron; propan-2-ylbismuth; tetraethylazanium Traditional Name: carbon monoxide; iron; isopropylbismuth; tetraethylammonium Formula: C31H47BiFe3N2O12+2 MolecularWeight: 1016.22646

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CC.CC[N+](CC)(CC)CC.CC(C)[Bi].[C-]#[O+].[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[N+](CC)(CC)CC.CC[N+](CC)(CC)CC.CC(C)[Bi].[C-]#[O+].[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/2C8H20N.C3H7.12CO.Bi.3Fe/c2*1-5-9(6-2,7-3)8-4;1-3-2;12*1-2;;;;/h2*5-8H2,1-4H3;3H,1-2H3;;;;;;;;;;;;;;;;/q2*+1;;;;;;;;;;;;;;;;;