Geometry & MOs

Info

ID:	10260
PubChem CID:	99557
Reduced:	NO5C13H13 (1)
Stoich.:	AB5C13D13 (1)
Weight, g/mol:	263.079373
ΔH_f, kcal/mol:	-158.12
Dipole, Da:	2.84
IP(EA), eV:	-9.08(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,5-dioxopyrrolidin-1-yl) 3-(4-hydroxyphenyl)propanoate

Drug info:

PubChemData

Smile

C1CC(=O)N(C1=O)OC(=O)CCC2=CC=C(C=C2)O

DOS

IR

Vibrations