Geometry & MOs

Info

ID:	55004
PubChem CID:	17389647
Reduced:	N2O4C11H22 (1)
Stoich.:	A2B4C11D22 (1)
Weight, g/mol:	245.061884
ΔH_f, kcal/mol:	-194.05
Dipole, Da:	10.92
IP(EA), eV:	-9.18(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-2-(3-fluorophenyl)pyrrolidine-3-carboxylic acid;hydrochloride

Drug info:

PubChemData

Smile

CN(C)CC1CCCCCN1.C(=O)(C(=O)O)O

DOS

IR

Vibrations