Geometry & MOs

Info

ID:	434397
PubChem CID:	135174840
Reduced:	OCl2F3N3H18C19 (1)
Stoich.:	AB2C3D3E18F19 (1)
Weight, g/mol:	274.095357
ΔH_f, kcal/mol:	-152.07
Dipole, Da:	5.27
IP(EA), eV:	-9.05(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-hydroxy-6-oxopiperidin-3-yl)-4-methylisoindole-1,3-dione

Drug info:

PubChemData

Smile

C1C(CN1)CNCC2=CC(=C(C=C2)NC(=O)C3=C(C=C(C=C3)Cl)C(F)(F)F)Cl

DOS

IR

Vibrations