methanidylidyneazanium

• ChemBase ID: 127744
• Molecular Formular: CHN
• Molecular Mass: 27.02534
• Monoisotopic Mass: 27.01089904
• SMILES: [C-]#[NH+]
• Canonical SMILES: [C-]#[NH+]
• InChI: InChI=1S/CHN/c1-2/h2H
• InChIKey: QIUBLANJVAOHHY-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: methanidylidyneazanium
• IUPAC Traditional name: hydrogen isocyanide
• Synonyms: isohydrocyanic acid; hydroisocyanic acid; isoprussic acid; nitriliomethanide; Hydrogen isocyanide

Database IDs

• PubChem SID: 162222062
• PubChem CID: 6432654
• CHEBI ID: 36856
• Chemspider ID: 4937885
• Wikipedia Title: Hydrogen_isocyanide

CALCULATED PROPERTIES

• Acid pKa: 9.5
• H Acceptors: 0
• H Donor: 1
• LogD (pH = 5.5): -0.34610683
• LogD (pH = 7.4): -0.33904728
• Log P: -0.34619832
• Molar Refractivity: 15.6795 cm^3
• Polarizability: 2.897986 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true