azane; aziridine; iron(3+); dodecaethanoate

Systemtic Name: azane; aziridine; iron(3+); dodecaethanoate Openeye Name: tetraferric; ammonia; aziridine; dodecaacetate CAS Name: ammonia; aziridine; iron(3+); dodecaacetate IUPAC Name: azane; aziridine; iron(3+); dodecaacetate Traditional Name: tetraferric; ammonia; ethylenimine; dodecaacetate Formula: C26H44Fe4N2O24 MolecularWeight: 992.00656

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].C1CN1.N.[Fe+3].[Fe+3].[Fe+3].[Fe+3]

Isomeric SMILES

CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].C1CN1.N.[Fe+3].[Fe+3].[Fe+3].[Fe+3]

InChI

InChI=1S/C2H5N.12C2H4O2.4Fe.H3N/c1-2-3-1;12*1-2(3)4;;;;;/h3H,1-2H2;12*1H3,(H,3,4);;;;;1H3/q;;;;;;;;;;;;;4*+3;/p-12