CID 134877915

C6FeK4N6-3 — CID 134877915

IUPAC—
SMILES[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe].[K+].[K+].[K+].[K]
InChIInChI=1S/6CN.Fe.4K/c6*1-2;;;;;/q6*-1;;;3*+1
InChIKeyFTBUHCQQTBNZCQ-UHFFFAOYSA-N
MW368.35 g/mol
LogP-8.79
Rot. Bonds

About CID 134877915

CID 134877915 (PubChem CID 134877915) has the molecular formula C6FeK4N6-3 and a molecular weight of 368.35 g/mol.

Molecular Properties

Compound NameCID 134877915
PubChem CID134877915
Molecular FormulaC6FeK4N6-3
Molecular Weight368.35 g/mol
Exact Mass367.81
IUPAC Name—
SMILES[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe].[K+].[K+].[K+].[K]
InChIInChI=1S/6CN.Fe.4K/c6*1-2;;;;;/q6*-1;;;3*+1
InChIKeyFTBUHCQQTBNZCQ-UHFFFAOYSA-N
XLogP-8.79
TPSA142.74 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.35
LogP ≤ 5-8.79
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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Related Compounds

dipotassium;cobalt(2+);iron;hexacyanide
CID 170853485
dipotassium;tetracyanide
CID 172816022
potassium;hydride;iron;iron(6+);hexacyanide
CID 173004482
potassium;hydride;iron;zinc;cyanide
CID 173426971
CID 160725252
CID 160725252
copper;iron;heptacyanide
CID 175220815
CID 174374628
CID 174374628
dipotassium;platinum;hexacyanide
CID 2733359
copper;potassium;tricyanide
CID 158672814
pentacopper;iron;dodecacyanide
CID 173219764
lithium;iron;cyanide
CID 174264357
potassium;cyanide;hydroiodide
CID 172814512

Frequently Asked Questions

What is the IUPAC name of CID 134877915?
The IUPAC name of CID 134877915 (CID 134877915) is not available.
What is the SMILES notation for CID 134877915?
The canonical SMILES for CID 134877915 is [C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe].[K+].[K+].[K+].[K].
What is the InChIKey of CID 134877915?
The InChIKey is FTBUHCQQTBNZCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/6CN.Fe.4K/c6*1-2;;;;;/q6*-1;;;3*+1.
What are the key properties of CID 134877915?
CID 134877915 has a molecular weight of 368.35 g/mol, XLogP of -8.79, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134877915 is sourced from PubChem (CID 134877915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).