Geometry & MOs

Info

ID:	269984
PubChem CID:	103621700
Reduced:	NF3O3C12H14 (1)
Stoich.:	AB3C3D12E14 (1)
Weight, g/mol:	387.9284
ΔH_f, kcal/mol:	-287.0
Dipole, Da:	2.94
IP(EA), eV:	-9.4(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-chloro-N-(6-methylsulfonylpyridin-3-yl)benzamide

Drug info:

PubChemData

Smile

CC(C)N(CC(F)(F)F)C(=O)C1=C(C=C(C=C1)O)O

DOS

IR

Vibrations