potassium;iron(2+);iron(3+);hexacyanide;hydrate

C6H2Fe2KN6O — CID 91886514

IUPACpotassium;iron(2+);iron(3+);hexacyanide;hydrate
SMILESO.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[Fe+3].[K+]
InChIInChI=1S/6CN.2Fe.K.H2O/c6*1-2;;;;/h;;;;;;;;;1H2/q6*-1;+2;+3;+1;
InChIKeyRFRXCIRDYYOPNY-UHFFFAOYSA-N
MW324.91 g/mol
LogP-3.25
Rot. Bonds

About potassium;iron(2+);iron(3+);hexacyanide;hydrate

potassium;iron(2+);iron(3+);hexacyanide;hydrate (PubChem CID 91886514) has the molecular formula C6H2Fe2KN6O and a molecular weight of 324.91 g/mol. Its IUPAC name is potassium;iron(2+);iron(3+);hexacyanide;hydrate.

Molecular Properties

Compound Namepotassium;iron(2+);iron(3+);hexacyanide;hydrate
PubChem CID91886514
Molecular FormulaC6H2Fe2KN6O
Molecular Weight324.91 g/mol
Exact Mass324.86
IUPAC Namepotassium;iron(2+);iron(3+);hexacyanide;hydrate
SMILESO.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[Fe+3].[K+]
InChIInChI=1S/6CN.2Fe.K.H2O/c6*1-2;;;;/h;;;;;;;;;1H2/q6*-1;+2;+3;+1;
InChIKeyRFRXCIRDYYOPNY-UHFFFAOYSA-N
XLogP-3.25
TPSA174.24 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.91
LogP ≤ 5-3.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of potassium;iron(2+);iron(3+);hexacyanide;hydrate?
The IUPAC name of potassium;iron(2+);iron(3+);hexacyanide;hydrate (CID 91886514) is potassium;iron(2+);iron(3+);hexacyanide;hydrate.
What is the SMILES notation for potassium;iron(2+);iron(3+);hexacyanide;hydrate?
The canonical SMILES for potassium;iron(2+);iron(3+);hexacyanide;hydrate is O.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[Fe+3].[K+].
What is the InChIKey of potassium;iron(2+);iron(3+);hexacyanide;hydrate?
The InChIKey is RFRXCIRDYYOPNY-UHFFFAOYSA-N. The full InChI is InChI=1S/6CN.2Fe.K.H2O/c6*1-2;;;;/h;;;;;;;;;1H2/q6*-1;+2;+3;+1;.
What are the key properties of potassium;iron(2+);iron(3+);hexacyanide;hydrate?
potassium;iron(2+);iron(3+);hexacyanide;hydrate has a molecular weight of 324.91 g/mol, XLogP of -3.25, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;iron(2+);iron(3+);hexacyanide;hydrate is sourced from PubChem (CID 91886514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).