Geometry & MOs

Info

ID:	304289
PubChem CID:	124501570
Reduced:	ON2C9H14 (1)
Stoich.:	AB2C9D14 (1)
Weight, g/mol:	183.071785
ΔH_f, kcal/mol:	-41.6
Dipole, Da:	4.37
IP(EA), eV:	-8.85(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(1S)-1-hydroxypropyl]-3-methyl-1H-pyridine-2-thione

Drug info:

PubChemData

Smile

CC[C@@H](C1=CNC(=O)C(=C1)C)N

DOS

IR

Vibrations