tripotassium;cerium;hydride;iron(6+);hexacyanide

C6H3CeFeK3N6 — CID 174557778

IUPACtripotassium;cerium;hydride;iron(6+);hexacyanide
SMILES[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Ce].[Fe+6].[H-].[H-].[H-].[K+].[K+].[K+]
InChIInChI=1S/6CN.Ce.Fe.3K.3H/c6*1-2;;;;;;;;/q6*-1;;+6;3*+1;3*-1
InChIKeyLYJAHDBLDMYSDS-UHFFFAOYSA-N
MW472.39 g/mol
LogP-8.07
Rot. Bonds

About tripotassium;cerium;hydride;iron(6+);hexacyanide

tripotassium;cerium;hydride;iron(6+);hexacyanide (PubChem CID 174557778) has the molecular formula C6H3CeFeK3N6 and a molecular weight of 472.39 g/mol. Its IUPAC name is tripotassium;cerium;hydride;iron(6+);hexacyanide.

Molecular Properties

Compound Nametripotassium;cerium;hydride;iron(6+);hexacyanide
PubChem CID174557778
Molecular FormulaC6H3CeFeK3N6
Molecular Weight472.39 g/mol
Exact Mass471.77
IUPAC Nametripotassium;cerium;hydride;iron(6+);hexacyanide
SMILES[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Ce].[Fe+6].[H-].[H-].[H-].[K+].[K+].[K+]
InChIInChI=1S/6CN.Ce.Fe.3K.3H/c6*1-2;;;;;;;;/q6*-1;;+6;3*+1;3*-1
InChIKeyLYJAHDBLDMYSDS-UHFFFAOYSA-N
XLogP-8.07
TPSA142.74 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500472.39
LogP ≤ 5-8.07
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 tripotassium;cerium;hydride;iron(6+);hexacyanide?
The IUPAC name of tripotassium;cerium;hydride;iron(6+);hexacyanide (CID 174557778) is tripotassium;cerium;hydride;iron(6+);hexacyanide.
What is the SMILES notation for tripotassium;cerium;hydride;iron(6+);hexacyanide?
The canonical SMILES for tripotassium;cerium;hydride;iron(6+);hexacyanide is [C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Ce].[Fe+6].[H-].[H-].[H-].[K+].[K+].[K+].
What is the InChIKey of tripotassium;cerium;hydride;iron(6+);hexacyanide?
The InChIKey is LYJAHDBLDMYSDS-UHFFFAOYSA-N. The full InChI is InChI=1S/6CN.Ce.Fe.3K.3H/c6*1-2;;;;;;;;/q6*-1;;+6;3*+1;3*-1.
What are the key properties of tripotassium;cerium;hydride;iron(6+);hexacyanide?
tripotassium;cerium;hydride;iron(6+);hexacyanide has a molecular weight of 472.39 g/mol, XLogP of -8.07, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tripotassium;cerium;hydride;iron(6+);hexacyanide is sourced from PubChem (CID 174557778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).