iron(3+); trimethyl(tetradecyl)azanium; hexacyanide

Systemtic Name: iron(3+); trimethyl(tetradecyl)azanium; hexacyanide Openeye Name: ferric trimethyl(tetradecyl)ammonium hexacyanide CAS Name: iron(3+); trimethyl(tetradecyl)ammonium; hexacyanide IUPAC Name: iron(3+); trimethyl(tetradecyl)azanium; hexacyanide Traditional Name: ferric trimethyl(myristyl)ammonium hexacyanide Formula: C57H114FeN9 MolecularWeight: 981.42036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC[N+](C)(C)C.CCCCCCCCCCCCCC[N+](C)(C)C.CCCCCCCCCCCCCC[N+](C)(C)C.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+3]

Isomeric SMILES

CCCCCCCCCCCCCC[N+](C)(C)C.CCCCCCCCCCCCCC[N+](C)(C)C.CCCCCCCCCCCCCC[N+](C)(C)C.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+3]

InChI

InChI=1S/3C17H38N.6CN.Fe/c3*1-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2,3)4;6*1-2;/h3*5-17H2,1-4H3;;;;;;;/q3*+1;6*-1;+3