Geometry & MOs

Info

ID:	23382
PubChem CID:	603300
Reduced:	BrClON2H8C12 (1)
Stoich.:	ABCD2E8F12 (1)
Weight, g/mol:	309.95085
ΔH_f, kcal/mol:	13.19
Dipole, Da:	3.02
IP(EA), eV:	-9.3(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-(5-chloropyridin-2-yl)benzamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Br)C(=O)NC2=NC=C(C=C2)Cl

DOS

IR

Vibrations