Geometry & MOs

Info

ID:	275481
PubChem CID:	103816416
Reduced:	BrClON2C9H10 (1)
Stoich.:	ABCD2E9F10 (1)
Weight, g/mol:	275.9665
ΔH_f, kcal/mol:	-24.75
Dipole, Da:	5.92
IP(EA), eV:	-9.25(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-6-chloropyridin-3-yl)butanamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations