Geometry & MOs

Info

ID:	275526
PubChem CID:	103816510
Reduced:	BrClON2C10H12 (1)
Stoich.:	ABCD2E10F12 (1)
Weight, g/mol:	310.9461
ΔH_f, kcal/mol:	-28.82
Dipole, Da:	5.95
IP(EA), eV:	-9.23(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-6-chloropyridin-3-yl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCC(C)C(=O)NC1=CC(=C(N=C1)Cl)Br

DOS

IR

Vibrations