sodium; azane; ethane; iron(3+); dodecaethanoate

Systemtic Name: sodium; azane; ethane; iron(3+); dodecaethanoate Openeye Name: tetraferric; sodium; ammonia; ethane; dodecaacetate CAS Name: sodium; ammonia; ethane; iron(3+); dodecaacetate IUPAC Name: sodium; azane; ethane; iron(3+); dodecaacetate Traditional Name: tetraferric; sodium; ammonia; ethane; dodecaacetate Formula: C26H59Fe4N6NaO24 MolecularWeight: 1086.14223

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Descriptors Computed from Structure

Canonical SMILES:

C[CH2-].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-].N.N.N.N.N.N.[Na+].[Fe+3].[Fe+3].[Fe+3].[Fe+3]

Isomeric SMILES

C[CH2-].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-].N.N.N.N.N.N.[Na+].[Fe+3].[Fe+3].[Fe+3].[Fe+3]

InChI

InChI=1S/12C2H4O2.C2H5.4Fe.6H3N.Na/c12*1-2(3)4;1-2;;;;;;;;;;;/h12*1H3,(H,3,4);1H2,2H3;;;;;6*1H3;/q;;;;;;;;;;;;-1;4*+3;;;;;;;+1/p-12