Geometry & MOs

Info

ID:	248467
PubChem CID:	103081896
Reduced:	BrNF2S2O3C9H12 (1)
Stoich.:	ABC2D2E3F9G12 (1)
Weight, g/mol:	324.014697
ΔH_f, kcal/mol:	-189.16
Dipole, Da:	4.2
IP(EA), eV:	-9.47(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-cyano-N-[2-(2,2-difluoroethoxy)ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)S(=O)(=O)NCCOCC(F)F)Br

DOS

IR

Vibrations