Geometry & MOs

Info

ID:	158491
PubChem CID:	56464031
Reduced:	SO3N5C20H23 (1)
Stoich.:	AB3C5D20E23 (1)
Weight, g/mol:	410.097014
ΔH_f, kcal/mol:	-32.76
Dipole, Da:	7.52
IP(EA), eV:	-9.09(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethylsulfonylethyl)-4-[methyl(phenyl)sulfamoyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(SC2=C1C(=O)N3CCCC3=N2)C(=O)NC(C4=NC(=NO4)C5CC5)C(C)C

DOS

IR

Vibrations