Geometry & MOs

Info

ID:	272687
PubChem CID:	103751699
Reduced:	BrON2H13C14 (1)
Stoich.:	ABC2D13E14 (1)
Weight, g/mol:	323.9665
ΔH_f, kcal/mol:	1.13
Dipole, Da:	2.94
IP(EA), eV:	-9.63(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(3-chloro-4-methylphenyl)pyridine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)NC(=O)C2=C(N=CC=C2)Br

DOS

IR

Vibrations