Geometry & MOs

Info

ID:	54137
PubChem CID:	14720378
Reduced:	NO4C15H17 (1)
Stoich.:	AB4C15D17 (1)
Weight, g/mol:	277.131408
ΔH_f, kcal/mol:	-136.99
Dipole, Da:	4.75
IP(EA), eV:	-9.77(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(1-benzoylpyrrolidin-2-yl)-2-hydroxyacetate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations