Geometry & MOs

Info

ID:	183533
PubChem CID:	77034554
Reduced:	NO2C13H21 (1)
Stoich.:	AB2C13D21 (1)
Weight, g/mol:	291.110673
ΔH_f, kcal/mol:	-87.91
Dipole, Da:	3.8
IP(EA), eV:	-8.51(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-methoxy-4-(1-methyl-2-oxopyrrolidin-3-yl)oxyphenyl]prop-2-enoic acid

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=CC=C1NCC(CO)O

DOS

IR

Vibrations