Geometry & MOs

Info

ID:	49123
PubChem CID:	11528735
Reduced:	O3C14H14 (1)
Stoich.:	A3B14C14 (1)
Weight, g/mol:	230.105528
ΔH_f, kcal/mol:	-94.43
Dipole, Da:	5.42
IP(EA), eV:	-9.96(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3S)-piperidin-3-yl]isoindole-1,3-dione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)C2=C(C(=O)OCC2)C

DOS

IR

Vibrations