Geometry & MOs

Info

ID:	158640
PubChem CID:	56464370
Reduced:	O3N4C23H28 (1)
Stoich.:	A3B4C23D28 (1)
Weight, g/mol:	458.142405
ΔH_f, kcal/mol:	-26.08
Dipole, Da:	6.72
IP(EA), eV:	-8.8(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylpropyl]-4-[(2-fluorophenyl)sulfamoyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(N1C2=CC(=CC=C2)OC)C)C(=O)NC(C3=NC(=NO3)C4CC4)C(C)C

DOS

IR

Vibrations