Geometry & MOs

Info

ID:	38133
PubChem CID:	8027354
Reduced:	ON2C12H18 (1)
Stoich.:	AB2C12D18 (1)
Weight, g/mol:	194.121927
ΔH_f, kcal/mol:	-19.85
Dipole, Da:	2.08
IP(EA), eV:	-7.78(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-N-[[(2S)-pyrrolidin-2-yl]methyl]aniline

Drug info:

PubChemData

Smile

COC1=CC=CC=C1NC[C@@H]2CCCN2

DOS

IR

Vibrations