Geometry & MOs

Info

ID:	339151
PubChem CID:	127260530
Reduced:	O5H8C10 (1)
Stoich.:	A5B8C10 (1)
Weight, g/mol:	263.079373
ΔH_f, kcal/mol:	-170.67
Dipole, Da:	1.32
IP(EA), eV:	-10.69(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(2-hydroxyethyl)-2,5-dioxopyrrolidin-1-yl] benzoate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1/C=C(/C(=O)O)\O)C(=O)O

DOS

IR

Vibrations