Geometry & MOs

Info

ID:	161959
PubChem CID:	57393179
Reduced:	N2O3C18H18 (1)
Stoich.:	A2B3C18D18 (1)
Weight, g/mol:	295.120843
ΔH_f, kcal/mol:	-49.56
Dipole, Da:	4.22
IP(EA), eV:	-9.38(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-5-oxo-1-[(4-phenylphenyl)methyl]pyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

C1CC(=O)N([C@@H]1C(=O)NO)CC2=CC=C(C=C2)C3=CC=CC=C3

DOS

IR

Vibrations