Geometry & MOs

Info

ID:	258417
PubChem CID:	103153632
Reduced:	NO5C14H21 (1)
Stoich.:	AB5C14D21 (1)
Weight, g/mol:	340.98989
ΔH_f, kcal/mol:	-241.65
Dipole, Da:	5.13
IP(EA), eV:	-10.12(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-bromo-1,3-dioxoisoindol-2-yl)-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

COC(CC(=O)O)CN1C(=O)CC2(C1=O)CCCCC2

DOS

IR

Vibrations