Geometry & MOs

Info

ID:	338745
PubChem CID:	127259756
Reduced:	NCl2O3H19C23 (1)
Stoich.:	AB2C3D19E23 (1)
Weight, g/mol:	253.050571
ΔH_f, kcal/mol:	-70.23
Dipole, Da:	6.07
IP(EA), eV:	-9.54(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-chloro-5-oxopyrrolidin-3-yl) 2-phenylacetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC(=O)OCCN(C2=C(C=CC=C2Cl)Cl)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations