Geometry & MOs

Info

ID:	278257
PubChem CID:	103834418
Reduced:	SN2O5C12H18 (1)
Stoich.:	AB2C5D12E18 (1)
Weight, g/mol:	309.06017
ΔH_f, kcal/mol:	-122.28
Dipole, Da:	3.28
IP(EA), eV:	-10.48(-2.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-fluoro-N-(2-hydroxy-4-methylpentyl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)CC(CNS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-])O

DOS

IR

Vibrations