Geometry & MOs

Info

ID:	266972
PubChem CID:	103580271
Reduced:	BrClON3C10H11 (1)
Stoich.:	ABCD3E10F11 (1)
Weight, g/mol:	291.9978
ΔH_f, kcal/mol:	-14.53
Dipole, Da:	4.07
IP(EA), eV:	-8.9(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1CCC(C1=O)NC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations