Geometry & MOs

Info

ID:	137672
PubChem CID:	52243344
Reduced:	N3O3C13H21 (1)
Stoich.:	A3B3C13D21 (1)
Weight, g/mol:	427.189592
ΔH_f, kcal/mol:	-92.64
Dipole, Da:	4.15
IP(EA), eV:	-9.44(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[(1S)-1-(3-benzamidophenyl)ethyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C[C@@H]1CN([C@H](CO1)C)C(=O)CCCC2=NC(=NO2)C

DOS

IR

Vibrations