Geometry & MOs

Info

ID:	444817
PubChem CID:	135263637
Reduced:	N3O4C11H21 (1)
Stoich.:	A3B4C11D21 (1)
Weight, g/mol:	278.090272
ΔH_f, kcal/mol:	-200.26
Dipole, Da:	5.49
IP(EA), eV:	-10.1(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-5-amino-4-(7-hydroxy-3-oxo-1H-isoindol-2-yl)-5-oxopentanoic acid

Drug info:

PubChemData

Smile

CC(CC(=O)O)C(C(=O)CCCCNC(=O)N)N

DOS

IR

Vibrations