AMMONIUM IRON(3+) HEXAKIS(CYANO-C)FERRATE(4-)

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Keyword(s): Food Contact Chemicals ; Plastic additives ; Drinking Water Chemicals
Molecule Category Salt-form
UNII 9R0NVI936I
EPA CompTox DTXSID1029332

Structure

InChI Key ILZWGESBVHGTRX-UHFFFAOYSA-O
Smiles [NH4+].[Fe++].[Fe+3].[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N
InChI
InChI=1S/6CN.2Fe.H3N/c6*1-2;;;/h;;;;;;;;1H3/q6*-1;+2;+3;/p+1

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H4Fe2N7
Molecular Weight 285.92
AlogP 0.95
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 1.0
Polar Surface Area 179.24
Heavy Atoms 15.0

Cross References

Resources Reference
CAS NUMBER 25869-00-5
NORMAN SUSDAT
FDA SRS 9R0NVI936I
CONTENTS