iron(6+); tetrahexylazanium; hexacyanide

Systemtic Name: iron(6+); tetrahexylazanium; hexacyanide Openeye Name: iron(6+); tetrahexylammonium; hexacyanide CAS Name: iron(6+); tetrahexylammonium; hexacyanide IUPAC Name: iron(6+); tetrahexylazanium; hexacyanide Traditional Name: iron(6+); tetrahexylammonium; hexacyanide Formula: C78H156FeN9+3 MolecularWeight: 1275.97854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+6]

Isomeric SMILES

CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+6]

InChI

InChI=1S/3C24H52N.6CN.Fe/c3*1-5-9-13-17-21-25(22-18-14-10-6-2,23-19-15-11-7-3)24-20-16-12-8-4;6*1-2;/h3*5-24H2,1-4H3;;;;;;;/q3*+1;6*-1;+6