Basic information
- Standard SMILES
Cc1ccc(SCSc2cccc[n+]2C)cc1- InChIKey
FWQPKEZHIDBFJC-UHFFFAOYSA-N- Molecular formula
- C14H16NS2+
- Average molar mass
- 262.4 g/mol
Names & identifiers
- Preferred name
- 1-Methyl-2-[(4-methylphenyl)sulfanylmethylsulfanyl]pyridin-1-ium
- IUPAC
- 1-methyl-2-[(4-methylphenyl)sulfanylmethylsulfanyl]pyridin-1-ium
Database identifiers
- PubChem CID
- 20525147
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 1
- Complexity
- 214
Related reactions
1 records
Compound notes
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