Geometry & MOs

Info

ID:	351842
PubChem CID:	127282242
Reduced:	O3N4C21H36 (1)
Stoich.:	A3B4C21D36 (1)
Weight, g/mol:	349.236542
ΔH_f, kcal/mol:	-170.62
Dipole, Da:	1.27
IP(EA), eV:	-8.67(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)-N-methyl-N-[(1-methylpiperidin-4-yl)methyl]propanamide

Drug info:

PubChemData

Smile

CC1CC(CC2(C1)C(=O)N(C(=O)N2)CC(=O)N(C)CC3CCN(CC3)C)(C)C

DOS

IR

Vibrations