Geometry & MOs

Info

ID:	267001
PubChem CID:	103580375
Reduced:	BrClON3C11H17 (1)
Stoich.:	ABCD3E11F17 (1)
Weight, g/mol:	307.99272
ΔH_f, kcal/mol:	-28.68
Dipole, Da:	2.03
IP(EA), eV:	-8.81(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[(5-bromo-3-chloropyridin-2-yl)amino]propoxy]ethanol

Drug info:

PubChemData

Smile

CC(CNC1=C(C=C(C=N1)Br)Cl)(CN(C)C)O

DOS

IR

Vibrations