Geometry & MOs

Info

ID:	278356
PubChem CID:	103835024
Reduced:	NSCl2O4C12H17 (1)
Stoich.:	ABC2D4E12F17 (1)
Weight, g/mol:	318.088557
ΔH_f, kcal/mol:	-168.06
Dipole, Da:	4.04
IP(EA), eV:	-9.83(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methoxy-2-methylbutyl)-4-nitrobenzenesulfonamide

Drug info:

PubChemData

Smile

CC(CCOC)(CNS(=O)(=O)C1=C(C=CC(=C1)Cl)Cl)O

DOS

IR

Vibrations