mercury(2+) ion λ2-cobalt(2+) ion tetrakis(cyanosulfanide)

• ChemBase ID: 302977
• Molecular Formular: C4CoHgN4S4
• Molecular Mass: 491.8528
• Monoisotopic Mass: 492.80441802
• SMILES: C(#N)[S-].C(#N)[S-].C(#N)[S-].C(#N)[S-].[Co+2].[Hg+2]
• Canonical SMILES: [S-]C#N.[S-]C#N.[S-]C#N.[S-]C#N.[Co+2].[Hg+2]
• InChI: InChI=1S/4CHNS.Co.Hg/c4*2-1-3;;/h4*3H;;/q;;;;2*+2/p-4
• InChIKey: CKGHPFRRZBSWMC-UHFFFAOYSA-J

NAMES AND DATABASE IDS

Names

• IUPAC name: mercury(2+) ion λ^2-cobalt(2+) ion tetrakis(cyanosulfanide)
• IUPAC Traditional name: mercury(2+) ion λ^2-cobalt(2+) ion tetrathiocyanate
• Synonyms: Cobalt(II) tetrathiocyanatomercurate; Mercury tetrathiocyanatocobaltate(II); 四硫氰钴(II)酸汞

Database IDs

• CAS Number: 27685-51-4
• EC Number: 248-602-4
• MDL Number: MFCD00011048

CALCULATED PROPERTIES

• Acid pKa: 0.49709612
• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): -0.6371734
• LogD (pH = 7.4): -0.63722837
• Log P: 0.5057529
• Molar Refractivity: 16.0894 cm^3
• Polarizability: 5.888356 Å^3
• Polar Surface Area: 23.79 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Crystalline

Safety Information

• European Hazard Symbols: Nature polluting (N); Highly toxic (T+)
• UN Number: UN2025
• Hazard Class: 6.1
• Packing Group: II
• Risk Statements: 26/27/28-32-33-42/43-50/53
• Safety Statements: 13-22-24-28-37-45-60-61
• TSCA Listed: 是
• GHS Pictograms: GHS06; GHS08; GHS09
• GHS Hazard statements: H300-H310-H330-H317-H334-H373-H400-H410
• GHS Precautionary statements: P260-P301+P310-P304+P340-P320-P330-P361-P405-P501A