Geometry & MOs

Info

ID:	278479
PubChem CID:	103836158
Reduced:	NSO3C10H21 (1)
Stoich.:	ABC3D10E21 (1)
Weight, g/mol:	316.109293
ΔH_f, kcal/mol:	-138.49
Dipole, Da:	2.22
IP(EA), eV:	-10.03(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-hydroxy-4-methylpentan-3-yl)-2-methyl-4-nitrobenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)C(CCO)NS(=O)(=O)CC1CC1

DOS

IR

Vibrations