Geometry & MOs

Info

ID:	209752
PubChem CID:	80712939
Reduced:	NSO4C15H19 (1)
Stoich.:	ABC4D15E19 (1)
Weight, g/mol:	317.053335
ΔH_f, kcal/mol:	-121.15
Dipole, Da:	6.89
IP(EA), eV:	-9.64(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-difluoro-6-(3-hydroxyprop-1-ynyl)-N-(oxolan-3-yl)benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)S(=O)(=O)NC2CCOC2)C#CCCO

DOS

IR

Vibrations