Geometry & MOs

Info

ID:	38140
PubChem CID:	8027396
Reduced:	NC6H9 (2)
Stoich.:	AB6C9 (2)
Weight, g/mol:	226.099867
ΔH_f, kcal/mol:	18.34
Dipole, Da:	0.94
IP(EA), eV:	-8.98(0.36)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(2S)-2-(5-chloro-2-ethoxyphenyl)pyrrolidin-1-ium

Drug info:

PubChemData

Smile

C1C[C@@H](NC1)CNCC2=CC=CC=C2

DOS

IR

Vibrations