Basic information
- CAS
1197-56-4- Standard SMILES
S=C([S-])Nc1ccc(Cl)cc1.[NH4+]- InChIKey
IVEZINAHHNNKTD-UHFFFAOYSA-N- Molecular formula
- C7H9ClN2S2
- Average molar mass
- 220.7 g/mol
- Monoisotopic mass
- 219.9895683
Names & identifiers
- Preferred name
- azanium N-(4-chlorophenyl)carbamodithioate
- IUPAC
- azanium N-(4-chlorophenyl)carbamodithioate
Database identifiers
- CAS
1197-56-4- PubChem CID
- 12374893
Properties
Computed structural properties
- Topological polar surface area
- 46.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 138
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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