Geometry & MOs

Info

ID:	278245
PubChem CID:	103834319
Reduced:	SCl2N2O3C11H16 (1)
Stoich.:	AB2C2D3E11F16 (1)
Weight, g/mol:	316.109293
ΔH_f, kcal/mol:	-121.36
Dipole, Da:	4.57
IP(EA), eV:	-10.32(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-4-methyl-3-nitrobenzenesulfonamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations