Chemical ID: 7369195

c1cc[n+](c(c1)[S-])[O-]
Chemical ID:
7369195
Name [?]:
1-oxidopyridine-2-thiolate
SMILES [?]:
c1cc[n+](c(c1)[S-])[O-]
InChi [?]:
InChI=1/C5H5NOS/c7-6-4-2-1-3-5(6)8/h1-4,8H/p-1
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,4,8,7/CRV:6.5/rA:8nCCCN+CCS-O-/rB:s1;d2;s3;d4;d1s5;s5;s4;/rC:;;;;;;;;

Chemical Details

Atom Count
Formula:C5H4NOS-
All Atoms:12
Heavy Atoms:8
Chiral Atoms:0
ZAP Information [?]
Total:-41.2982
Area:266.114
Solvation:-47.951
Coulombic:13.1835
Bond Count [?]
All:8
Single:5
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:126.157
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:0.71
LogP (Chemaxon):-0.32

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Descriptor Annotations

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