Geometry & MOs

Info

ID:	72724
PubChem CID:	48416477
Reduced:	N3O3C17H23 (1)
Stoich.:	A3B3C17D23 (1)
Weight, g/mol:	362.195405
ΔH_f, kcal/mol:	-110.97
Dipole, Da:	0.53
IP(EA), eV:	-8.8(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-oxo-2-[3-(2-oxoimidazolidin-1-yl)piperidin-1-yl]ethyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CC(=O)N2CCCC(C2)N3CCNC3=O

DOS

IR

Vibrations