Geometry & MOs

Info

ID:	341233
PubChem CID:	127263668
Reduced:	ClN2F3C7H8 (1)
Stoich.:	AB2C3D7E8 (1)
Weight, g/mol:	212.03281
ΔH_f, kcal/mol:	-161.8
Dipole, Da:	2.67
IP(EA), eV:	-10.3(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-2,2,2-trifluoro-1-pyridin-3-ylethanamine;hydrochloride

Drug info:

PubChemData

Smile

C1=CN=CC=C1[C@H](C(F)(F)F)N.Cl

DOS

IR

Vibrations