Geometry & MOs

Info

ID:	55005
PubChem CID:	17389649
Reduced:	ClFNO2C11H13 (1)
Stoich.:	ABCD2E11F13 (1)
Weight, g/mol:	209.085207
ΔH_f, kcal/mol:	-147.71
Dipole, Da:	3.87
IP(EA), eV:	-9.94(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CNC([C@H]1C(=O)O)C2=CC(=CC=C2)F.Cl

DOS

IR

Vibrations