Geometry & MOs

Info

ID:	207631
PubChem CID:	80429293
Reduced:	OS2N3C8H13 (1)
Stoich.:	AB2C3D8E13 (1)
Weight, g/mol:	217.034354
ΔH_f, kcal/mol:	1.97
Dipole, Da:	1.27
IP(EA), eV:	-9.12(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-methyl-1,2,4-thiadiazol-5-yl)sulfanyl]butanamide

Drug info:

PubChemData

Smile

CC1=NSC(=N1)SCC2CNCCO2

DOS

IR

Vibrations