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ScientificNameLabel
Pyridinethione
PHCD compound ID : 1785
Chemical Names :
Pyridinethione , 2-Pyridinethione
Molecular Formula : C5H5N1S1
Molecular Weight : 111.01427
More Details :
Names & Synonyms: 1H-pyridine-2-thione
Smiles: S=c1cccc[nH]1
InChi : InChI=1S/C5H5NS/c7-5-3-1-2-4-6-5/h1-4H,(H,6,7)
InChi Key : InChIKey=WHMDPDGBKYUEMW-UHFFFAOYSA-N
PubChem ID : 2723698
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 8.328508
Hydrogen bond donor count : 1 Electric dipole moment : 5.914
XLogP : 0.779 VDW volume : 104.276331
Molecular weight : 111.01427 HOMO-LUMO gap : 7.267000
Herb list :
Refrences & Litretures:
  
202.      Journal:'Biotech Health Sci'      Year:'2015'      Volume:'2'      Page:'e26797'      DOI:'10.17795/bhs-26797'      Title:'Biological Properties of Vitex agnus-castus Essential Oil (Phytochemical Component, Antioxidant and Antifungal Activity)'
703.      Journal:'BioMed Research International'      Year:'2013'      Volume:'2013'      Page:'1'      DOI:'10.1155/2013/696835'      Title:'Chemical Composition and Antibacterial and Cytotoxic Activities of Allium hirtifolium Boiss'
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