Geometry & MOs

Info

ID:	158516
PubChem CID:	56464118
Reduced:	S2O3N5C21H25 (1)
Stoich.:	A2B3C5D21E25 (1)
Weight, g/mol:	406.167477
ΔH_f, kcal/mol:	-28.89
Dipole, Da:	4.7
IP(EA), eV:	-8.5(-0.98)
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]-5-(ethylsulfamoyl)-2-methylbenzamide

Drug info:

PubChemData

Smile

CC(C)C(C1=NC(=NO1)C2CC2)NC(=O)CSCC3=NC4=C(C5=C(S4)CCC5)C(=O)N3

DOS

IR

Vibrations