Geometry & MOs

Info

ID:	54139
PubChem CID:	14720380
Reduced:	NO4C15H19 (1)
Stoich.:	AB4C15D19 (1)
Weight, g/mol:	277.131408
ΔH_f, kcal/mol:	-160.41
Dipole, Da:	6.81
IP(EA), eV:	-9.63(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2R)-2-[(2S)-1-benzoylpyrrolidin-2-yl]-2-hydroxyacetate

Drug info:

PubChemData

Smile

CCOC(=O)C([C@@H]1CCCN1C(=O)C2=CC=CC=C2)O

DOS

IR

Vibrations