Geometry & MOs

Info

ID:	153981
PubChem CID:	56313339
Reduced:	OSF3N4C16H21 (1)
Stoich.:	ABC3D4E16F21 (1)
Weight, g/mol:	351.125277
ΔH_f, kcal/mol:	-139.78
Dipole, Da:	4.04
IP(EA), eV:	-8.98(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[[4-(methylsulfamoyl)phenyl]methyl]propanamide

Drug info:

PubChemData

Smile

CC(C)N1C(=C(C=N1)C(=O)NCC(C2=CSC=C2)N(C)C)C(F)(F)F

DOS

IR

Vibrations