Geometry & MOs

Info

ID:	5239
PubChem CID:	12811
Reduced:	SN2O2C7H8 (1)
Stoich.:	AB2C2D7E8 (1)
Weight, g/mol:	184.030649
ΔH_f, kcal/mol:	-53.35
Dipole, Da:	4.48
IP(EA), eV:	-9.55(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-oxo-N-(1,3-thiazol-2-yl)butanamide

Drug info:

PubChemData

Smile

CC(=O)CC(=O)NC1=NC=CS1

DOS

IR

Vibrations