Geometry & MOs

Info

ID:	202800
PubChem CID:	79728897
Reduced:	O3C13H16 (1)
Stoich.:	A3B13C16 (1)
Weight, g/mol:	387.90452
ΔH_f, kcal/mol:	-110.1
Dipole, Da:	6.81
IP(EA), eV:	-8.98(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(5-bromo-4-methylpyridin-2-yl)-4-fluorobenzamide

Drug info:

PubChemData

Smile

CC(=C(C)C(=O)O)CC1=CC=CC=C1OC

DOS

IR

Vibrations