trisodium;iron(2+);pentacyanide

C5FeN5Na3 — CID 157307614

IUPACtrisodium;iron(2+);pentacyanide
SMILES[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[Na+].[Na+].[Na+]
InChIInChI=1S/5CN.Fe.3Na/c5*1-2;;;;/q5*-1;+2;3*+1
InChIKeyOOTLMFIATXFKQS-UHFFFAOYSA-N
MW254.90 g/mol
LogP-8.51
Rot. Bonds

About trisodium;iron(2+);pentacyanide

trisodium;iron(2+);pentacyanide (PubChem CID 157307614) has the molecular formula C5FeN5Na3 and a molecular weight of 254.90 g/mol. Its IUPAC name is trisodium;iron(2+);pentacyanide.

Molecular Properties

Compound Nametrisodium;iron(2+);pentacyanide
PubChem CID157307614
Molecular FormulaC5FeN5Na3
Molecular Weight254.90 g/mol
Exact Mass254.92
IUPAC Nametrisodium;iron(2+);pentacyanide
SMILES[C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[Na+].[Na+].[Na+]
InChIInChI=1S/5CN.Fe.3Na/c5*1-2;;;;/q5*-1;+2;3*+1
InChIKeyOOTLMFIATXFKQS-UHFFFAOYSA-N
XLogP-8.51
TPSA118.95 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.90
LogP ≤ 5-8.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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

sodium;iron(2+);tricyanide
CID 159498297
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 trisodium;iron(2+);pentacyanide?
The IUPAC name of trisodium;iron(2+);pentacyanide (CID 157307614) is trisodium;iron(2+);pentacyanide.
What is the SMILES notation for trisodium;iron(2+);pentacyanide?
The canonical SMILES for trisodium;iron(2+);pentacyanide is [C-]#N.[C-]#N.[C-]#N.[C-]#N.[C-]#N.[Fe+2].[Na+].[Na+].[Na+].
What is the InChIKey of trisodium;iron(2+);pentacyanide?
The InChIKey is OOTLMFIATXFKQS-UHFFFAOYSA-N. The full InChI is InChI=1S/5CN.Fe.3Na/c5*1-2;;;;/q5*-1;+2;3*+1.
What are the key properties of trisodium;iron(2+);pentacyanide?
trisodium;iron(2+);pentacyanide has a molecular weight of 254.90 g/mol, XLogP of -8.51, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trisodium;iron(2+);pentacyanide is sourced from PubChem (CID 157307614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).