Geometry & MOs

Info

ID:	131052
PubChem CID:	51148962
Reduced:	ClO2N3C20H30 (1)
Stoich.:	AB2C3D20E30 (1)
Weight, g/mol:	363.252192
ΔH_f, kcal/mol:	-107.56
Dipole, Da:	5.76
IP(EA), eV:	-8.51(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-N-(2-methyl-2-piperidin-1-ylpropyl)propanamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)CCCNC(=O)C1=CC=C(C=C1)Cl)N2CCCCC2

DOS

IR

Vibrations