Geometry & MOs

Info

ID:	277116
PubChem CID:	103826801
Reduced:	BrClNOF3H8C10 (1)
Stoich.:	ABCDE3F8G10 (1)
Weight, g/mol:	352.99305
ΔH_f, kcal/mol:	-184.5
Dipole, Da:	3.01
IP(EA), eV:	-10.12(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-5-chloro-N-[2-(dimethylamino)pyridin-3-yl]benzamide

Drug info:

PubChemData

Smile

CN(CC(F)(F)F)C(=O)C1=CC(=CC(=C1)Br)Cl

DOS

IR

Vibrations