Geometry & MOs

Info

ID:	275525
PubChem CID:	103816509
Reduced:	BrClN2O2H8C11 (1)
Stoich.:	ABC2D2E8F11 (1)
Weight, g/mol:	289.98215
ΔH_f, kcal/mol:	-20.5
Dipole, Da:	6.51
IP(EA), eV:	-9.23(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-bromo-6-chloropyridin-3-yl)-2-methylbutanamide

Drug info:

PubChemData

Smile

CC1=C(OC=C1)C(=O)NC2=CC(=C(N=C2)Cl)Br

DOS

IR

Vibrations