Geometry & MOs

Info

ID:	448697
PubChem CID:	135292844
Reduced:	N3O13C26H33 (1)
Stoich.:	A3B13C26D33 (1)
Weight, g/mol:	323.07535
ΔH_f, kcal/mol:	-484.6
Dipole, Da:	5.35
IP(EA), eV:	-8.9(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(7-amino-4,5,6-trihydroxy-3-oxo-1H-isoindol-2-yl)-3-hydroxypiperidine-2,6-dione

Drug info:

PubChemData

Smile

CNC(=O)C(C(C(C=O)(N1C/C(=C(/O)\OCC2=CC=C(C=C2)CN3CCOCC3)/C(=C(\C(=C)O)/O)/C1=O)O)(O)O)(O)O

DOS

IR

Vibrations