Geometry & MOs

Info

ID:	272319
PubChem CID:	103739670
Reduced:	BrNO2S3C9H12 (1)
Stoich.:	ABC2D3E9F12 (1)
Weight, g/mol:	328.98336
ΔH_f, kcal/mol:	-48.35
Dipole, Da:	4.12
IP(EA), eV:	-8.71(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-4-methyl-N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)S(=O)(=O)NC2CCSC2)Br

DOS

IR

Vibrations