Geometry & MOs

Info

ID:	158315
PubChem CID:	56463343
Reduced:	SN4O4C24H28 (1)
Stoich.:	AB4C4D24E28 (1)
Weight, g/mol:	496.178041
ΔH_f, kcal/mol:	-63.74
Dipole, Da:	4.44
IP(EA), eV:	-9.05(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(4-acetylphenyl)sulfonylamino]methyl]-N-[1-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylpropyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NC(C3=NC(=NO3)C4CC4)C(C)C)C

DOS

IR

Vibrations