cobalt(2+);iron(4+);hexacyanide

C6CoFeN6 — CID 87398573

IUPACcobalt(2+);iron(4+);hexacyanide
SMILES[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Co+2].[Fe+4]
InChIInChI=1S/6CN.Co.Fe/c6*1-2;;/q6*-1;+2;+4
InChIKeyBLLRWPMATHBWOX-UHFFFAOYSA-N
MW270.89 g/mol
LogP0.57
Rot. Bonds

About cobalt(2+);iron(4+);hexacyanide

cobalt(2+);iron(4+);hexacyanide (PubChem CID 87398573) has the molecular formula C6CoFeN6 and a molecular weight of 270.89 g/mol. Its IUPAC name is cobalt(2+);iron(4+);hexacyanide.

Molecular Properties

Compound Namecobalt(2+);iron(4+);hexacyanide
PubChem CID87398573
Molecular FormulaC6CoFeN6
Molecular Weight270.89 g/mol
Exact Mass270.89
IUPAC Namecobalt(2+);iron(4+);hexacyanide
SMILES[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Co+2].[Fe+4]
InChIInChI=1S/6CN.Co.Fe/c6*1-2;;/q6*-1;+2;+4
InChIKeyBLLRWPMATHBWOX-UHFFFAOYSA-N
XLogP0.57
TPSA142.74 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.89
LogP ≤ 50.57
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 cobalt(2+);iron(4+);hexacyanide?
The IUPAC name of cobalt(2+);iron(4+);hexacyanide (CID 87398573) is cobalt(2+);iron(4+);hexacyanide.
What is the SMILES notation for cobalt(2+);iron(4+);hexacyanide?
The canonical SMILES for cobalt(2+);iron(4+);hexacyanide is [C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Co+2].[Fe+4].
What is the InChIKey of cobalt(2+);iron(4+);hexacyanide?
The InChIKey is BLLRWPMATHBWOX-UHFFFAOYSA-N. The full InChI is InChI=1S/6CN.Co.Fe/c6*1-2;;/q6*-1;+2;+4.
What are the key properties of cobalt(2+);iron(4+);hexacyanide?
cobalt(2+);iron(4+);hexacyanide has a molecular weight of 270.89 g/mol, XLogP of 0.57, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt(2+);iron(4+);hexacyanide is sourced from PubChem (CID 87398573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).