Geometry & MOs

Info

ID:	63847
PubChem CID:	26759310
Reduced:	BrNF3O3H17C19 (1)
Stoich.:	ABC3D3E17F19 (1)
Weight, g/mol:	360.114378
ΔH_f, kcal/mol:	-262.78
Dipole, Da:	2.48
IP(EA), eV:	-8.89(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-5-morpholin-4-ylsulfonylphenyl)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)[C@@H](C)OC(=O)CC2=CC(=CC=C2)C(F)(F)F)Br

DOS

IR

Vibrations