Geometry & MOs

Info

ID:	199494
PubChem CID:	79255340
Reduced:	NSO5C13H21 (1)
Stoich.:	ABC5D13E21 (1)
Weight, g/mol:	291.069592
ΔH_f, kcal/mol:	-204.56
Dipole, Da:	7.27
IP(EA), eV:	-9.41(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)C(CO)NS(=O)(=O)C1=C(C=C(C=C1)OC)OC

DOS

IR

Vibrations