Geometry & MOs

Info

ID:	365052
PubChem CID:	127316733
Reduced:	ON3C16H23 (1)
Stoich.:	AB3C16D23 (1)
Weight, g/mol:	333.205242
ΔH_f, kcal/mol:	-33.41
Dipole, Da:	4.77
IP(EA), eV:	-8.79(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(3-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-2-oxoethyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1C(=O)C3=C(N=C(C=C3)C)C

DOS

IR

Vibrations