Geometry & MOs

Info

ID:	279144
PubChem CID:	103841664
Reduced:	BrClNO2H15C16 (1)
Stoich.:	ABCD2E15F16 (1)
Weight, g/mol:	323.9665
ΔH_f, kcal/mol:	-39.75
Dipole, Da:	2.15
IP(EA), eV:	-9.47(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-4-chloro-N-(3-methylpyridin-2-yl)benzamide

Drug info:

PubChemData

Smile

COCC1=CC=CC(=C1)CNC(=O)C2=CC(=C(C=C2)Cl)Br

DOS

IR

Vibrations