Geometry & MOs

Info

ID:	32022
PubChem CID:	4253279
Reduced:	ClNSO3C14H20 (1)
Stoich.:	ABCD3E14F20 (1)
Weight, g/mol:	570.197063
ΔH_f, kcal/mol:	-162.24
Dipole, Da:	2.27
IP(EA), eV:	-8.59(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-[bis(2-methylpropyl)sulfamoyl]-1,3-benzothiazol-2-yl]-2-(1,3-dioxoisoindol-2-yl)-3-methylbutanamide

Drug info:

PubChemData

Smile

CCC1=C(SC(=C1C(=O)OCC)NC(=O)CCCCl)C

DOS

IR

Vibrations