sodium;iron(2+);tricyanide

C3FeN3Na — CID 159498297

IUPACsodium;iron(2+);tricyanide
SMILES[C-]#N.[C-]#N.[C-]#N.[Fe+2].[Na+]
InChIInChI=1S/3CN.Fe.Na/c3*1-2;;/q3*-1;+2;+1
InChIKeyLZBCBAVHVIKREY-UHFFFAOYSA-N
MW156.89 g/mol
LogP-2.71
Rot. Bonds

About sodium;iron(2+);tricyanide

sodium;iron(2+);tricyanide (PubChem CID 159498297) has the molecular formula C3FeN3Na and a molecular weight of 156.89 g/mol. Its IUPAC name is sodium;iron(2+);tricyanide.

Molecular Properties

Compound Namesodium;iron(2+);tricyanide
PubChem CID159498297
Molecular FormulaC3FeN3Na
Molecular Weight156.89 g/mol
Exact Mass156.93
IUPAC Namesodium;iron(2+);tricyanide
SMILES[C-]#N.[C-]#N.[C-]#N.[Fe+2].[Na+]
InChIInChI=1S/3CN.Fe.Na/c3*1-2;;/q3*-1;+2;+1
InChIKeyLZBCBAVHVIKREY-UHFFFAOYSA-N
XLogP-2.71
TPSA71.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.89
LogP ≤ 5-2.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze sodium;iron(2+);tricyanide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

trisodium;iron(2+);pentacyanide
CID 157307614
sodium;cobalt(2+);iron(2+);pentacyanide
CID 169093006
sodium cyanide
CID 8929
trisodium;azane;iron(2+);pentacyanide;trihydrate
CID 25016380
tetrakis(chromium(3+));tris(iron(2+));octadecacyanide
CID 173180895
silver;sodium;cyanide
CID 23700743
sodium;hydride;cyanide
CID 24940185
iron(2+);iron(4+);hexacyanide
CID 20846158
sodium;cyanide;hydrobromide
CID 139950314
pentapotassium;iron(2+);heptacyanide
CID 173150440
iron(2+);manganese(2+);tetracyanide
CID 163753486
sodium;rhodium(2+);cyanide
CID 23681508

Frequently Asked Questions

What is the IUPAC name of sodium;iron(2+);tricyanide?
The IUPAC name of sodium;iron(2+);tricyanide (CID 159498297) is sodium;iron(2+);tricyanide.
What is the SMILES notation for sodium;iron(2+);tricyanide?
The canonical SMILES for sodium;iron(2+);tricyanide is [C-]#N.[C-]#N.[C-]#N.[Fe+2].[Na+].
What is the InChIKey of sodium;iron(2+);tricyanide?
The InChIKey is LZBCBAVHVIKREY-UHFFFAOYSA-N. The full InChI is InChI=1S/3CN.Fe.Na/c3*1-2;;/q3*-1;+2;+1.
What are the key properties of sodium;iron(2+);tricyanide?
sodium;iron(2+);tricyanide has a molecular weight of 156.89 g/mol, XLogP of -2.71, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;iron(2+);tricyanide is sourced from PubChem (CID 159498297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).