Geometry & MOs

Info

ID:	267540
PubChem CID:	103582667
Reduced:	BrClN2C11H16 (1)
Stoich.:	ABC2D11E16 (1)
Weight, g/mol:	297.95085
ΔH_f, kcal/mol:	-2.49
Dipole, Da:	3.02
IP(EA), eV:	-8.68(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-bromo-3-chloropyridin-2-yl)oxyaniline

Drug info:

PubChemData

Smile

CCC(C)(C)CNC1=C(C=C(C=N1)Br)Cl

DOS

IR

Vibrations