trizinc; 1,4-dioxane; iron(6+); dodecacyanide

Systemtic Name: trizinc; 1,4-dioxane; iron(6+); dodecacyanide Openeye Name: trizinc; 1,4-dioxane; iron(6+); dodecacyanide CAS Name: trizinc; 1,4-dioxane; iron(6+); dodecacyanide IUPAC Name: trizinc; 1,4-dioxane; iron(6+); dodecacyanide Traditional Name: trizinc; 1,4-dioxane; iron(6+); dodecacyanide Formula: C24H24Fe2N12O6Zn3+6 MolecularWeight: 884.44116

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.C1COCCO1.C1COCCO1.C1COCCO1.[Fe+6].[Fe+6].[Zn+2].[Zn+2].[Zn+2]

Isomeric SMILES

[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.C1COCCO1.C1COCCO1.C1COCCO1.[Fe+6].[Fe+6].[Zn+2].[Zn+2].[Zn+2]

InChI

InChI=1S/3C4H8O2.12CN.2Fe.3Zn/c3*1-2-6-4-3-5-1;12*1-2;;;;;/h3*1-4H2;;;;;;;;;;;;;;;;;/q;;;12*-1;2*+6;3*+2