Geometry & MOs

Info

ID:	201869
PubChem CID:	79594322
Reduced:	NSO2C6H9 (2)
Stoich.:	ABC2D6E9 (2)
Weight, g/mol:	277.078407
ΔH_f, kcal/mol:	-117.12
Dipole, Da:	4.49
IP(EA), eV:	-8.78(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-fluoro-4-hydroxyphenyl)-2-propan-2-yloxyethanesulfonamide

Drug info:

PubChemData

Smile

CC(C)OCCS(=O)(=O)NC1=NC=C(S1)C#CCCO

DOS

IR

Vibrations