Geometry & MOs

Info

ID:	139556
PubChem CID:	52557536
Reduced:	S2N3O4H13C14 (1)
Stoich.:	A2B3C4D13E14 (1)
Weight, g/mol:	411.035891
ΔH_f, kcal/mol:	-77.85
Dipole, Da:	3.21
IP(EA), eV:	-8.93(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R)-1-[3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]ethyl] 5-sulfamoylthiophene-3-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=CN2C1=NC(=C2)COC(=O)C3=CSC(=C3)S(=O)(=O)N

DOS

IR

Vibrations