Geometry & MOs

Info

ID:	341970
PubChem CID:	127264663
Reduced:	BrON2C5H9 (1)
Stoich.:	ABC2D5E9 (1)
Weight, g/mol:	227.998781
ΔH_f, kcal/mol:	-46.23
Dipole, Da:	5.86
IP(EA), eV:	-7.74(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(5-chloropyridin-3-yl)ethanamine;dihydrochloride

Drug info:

PubChemData

Smile

CC1=NC(=CO1)CN.Br

DOS

IR

Vibrations