sodium;formonitrile;cyanide

C2HN2Na — CID 161198529

IUPACsodium;formonitrile;cyanide
SMILESC#N.[C-]#N.[Na+]
InChIInChI=1S/CHN.CN.Na/c2*1-2;/h1H;;/q;-1;+1
InChIKeyUURCPTAHRNCSNC-UHFFFAOYSA-N
MW76.03 g/mol
LogP-2.76
Rot. Bonds

About sodium;formonitrile;cyanide

sodium;formonitrile;cyanide (PubChem CID 161198529) has the molecular formula C2HN2Na and a molecular weight of 76.03 g/mol. Its IUPAC name is sodium;formonitrile;cyanide.

Molecular Properties

Compound Namesodium;formonitrile;cyanide
PubChem CID161198529
Molecular FormulaC2HN2Na
Molecular Weight76.03 g/mol
Exact Mass76.00
IUPAC Namesodium;formonitrile;cyanide
SMILESC#N.[C-]#N.[Na+]
InChIInChI=1S/CHN.CN.Na/c2*1-2;/h1H;;/q;-1;+1
InChIKeyUURCPTAHRNCSNC-UHFFFAOYSA-N
XLogP-2.76
TPSA47.58 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50076.03
LogP ≤ 5-2.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

sodium cyanide
CID 8929
trisodium;iron(2+);pentacyanide
CID 157307614
sodium;iron(2+);tricyanide
CID 159498297
sodium;rhodium(2+);cyanide
CID 23681508
sodium;cyanide;hydrobromide
CID 139950314
silver;sodium;cyanide
CID 23700743
sodium;hydride;cyanide
CID 24940185
(15N)azanylidynemethane
CID 11062296
sodium;cobalt;hexakis(formonitrile);hydride
CID 175576977
sodium;cobalt(2+);iron(2+);pentacyanide
CID 169093006
sodium;hydride;ruthenium(1+);cyanide
CID 174621752
disodium;hydride;iron;cyanide
CID 174748463

Frequently Asked Questions

What is the IUPAC name of sodium;formonitrile;cyanide?
The IUPAC name of sodium;formonitrile;cyanide (CID 161198529) is sodium;formonitrile;cyanide.
What is the SMILES notation for sodium;formonitrile;cyanide?
The canonical SMILES for sodium;formonitrile;cyanide is C#N.[C-]#N.[Na+].
What is the InChIKey of sodium;formonitrile;cyanide?
The InChIKey is UURCPTAHRNCSNC-UHFFFAOYSA-N. The full InChI is InChI=1S/CHN.CN.Na/c2*1-2;/h1H;;/q;-1;+1.
What are the key properties of sodium;formonitrile;cyanide?
sodium;formonitrile;cyanide has a molecular weight of 76.03 g/mol, XLogP of -2.76, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;formonitrile;cyanide is sourced from PubChem (CID 161198529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).