pentapotassium;iron(2+);heptacyanide

C7FeK5N7 — CID 173150440

IUPACpentapotassium;iron(2+);heptacyanide
SMILES[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[K+].[K+].[K+].[K+].[K+]
InChIInChI=1S/7CN.Fe.5K/c7*1-2;;;;;;/q7*-1;+2;5*+1
InChIKeyTUVSIRIWTKQOQL-UHFFFAOYSA-N
MW433.46 g/mol
LogP-14.31
Rot. Bonds

About pentapotassium;iron(2+);heptacyanide

pentapotassium;iron(2+);heptacyanide (PubChem CID 173150440) has the molecular formula C7FeK5N7 and a molecular weight of 433.46 g/mol. Its IUPAC name is pentapotassium;iron(2+);heptacyanide.

Molecular Properties

Compound Namepentapotassium;iron(2+);heptacyanide
PubChem CID173150440
Molecular FormulaC7FeK5N7
Molecular Weight433.46 g/mol
Exact Mass432.77
IUPAC Namepentapotassium;iron(2+);heptacyanide
SMILES[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[K+].[K+].[K+].[K+].[K+]
InChIInChI=1S/7CN.Fe.5K/c7*1-2;;;;;;/q7*-1;+2;5*+1
InChIKeyTUVSIRIWTKQOQL-UHFFFAOYSA-N
XLogP-14.31
TPSA166.53 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.46
LogP ≤ 5-14.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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 pentapotassium;iron(2+);heptacyanide?
The IUPAC name of pentapotassium;iron(2+);heptacyanide (CID 173150440) is pentapotassium;iron(2+);heptacyanide.
What is the SMILES notation for pentapotassium;iron(2+);heptacyanide?
The canonical SMILES for pentapotassium;iron(2+);heptacyanide is [C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[K+].[K+].[K+].[K+].[K+].
What is the InChIKey of pentapotassium;iron(2+);heptacyanide?
The InChIKey is TUVSIRIWTKQOQL-UHFFFAOYSA-N. The full InChI is InChI=1S/7CN.Fe.5K/c7*1-2;;;;;;/q7*-1;+2;5*+1.
What are the key properties of pentapotassium;iron(2+);heptacyanide?
pentapotassium;iron(2+);heptacyanide has a molecular weight of 433.46 g/mol, XLogP of -14.31, 0 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for pentapotassium;iron(2+);heptacyanide is sourced from PubChem (CID 173150440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).