Geometry & MOs

Info

ID:	258917
PubChem CID:	103157412
Reduced:	NO2C18H29 (1)
Stoich.:	AB2C18D29 (1)
Weight, g/mol:	237.067094
ΔH_f, kcal/mol:	-102.94
Dipole, Da:	3.24
IP(EA), eV:	-8.7(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,1-dioxo-1,2-thiazolidin-2-yl)-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OCC(C)NCC(CC2CCCC2)O

DOS

IR

Vibrations