Geometry & MOs

Info

ID:	341976
PubChem CID:	127264669
Reduced:	ClFNOC4H5 (2)
Stoich.:	ABCDE4F5 (2)
Weight, g/mol:	238.043982
ΔH_f, kcal/mol:	-222.39
Dipole, Da:	5.28
IP(EA), eV:	-10.21(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-2-[(2S)-pyrrolidin-2-yl]pyridine;dihydrochloride

Drug info:

PubChemData

Smile

C1=CC(=NC(=C1C[C@@H](C(=O)O)N)F)F.Cl.Cl

DOS

IR

Vibrations