Geometry & MOs

Info

ID:	269307
PubChem CID:	103616942
Reduced:	ClN2O2S2F3C8H8 (1)
Stoich.:	AB2C2D2E3F8G8 (1)
Weight, g/mol:	392.93158
ΔH_f, kcal/mol:	-211.7
Dipole, Da:	1.25
IP(EA), eV:	-10.0(-1.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-methoxy-N-[2-(trifluoromethylsulfanyl)ethyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC(=NC=C1S(=O)(=O)NCCSC(F)(F)F)Cl

DOS

IR

Vibrations