Geometry & MOs

Info

ID:	361059
PubChem CID:	127301949
Reduced:	O3N4C20H34 (1)
Stoich.:	A3B4C20D34 (1)
Weight, g/mol:	349.236542
ΔH_f, kcal/mol:	-169.92
Dipole, Da:	1.58
IP(EA), eV:	-8.69(0.19)
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-[(1-ethylpiperidin-2-yl)methyl]propanamide

Drug info:

PubChemData

Smile

CCC1CCC2(CC1)C(=O)N(C(=O)N2)CC(=O)NCC3CCCCN3CC

DOS

IR

Vibrations