Geometry & MOs

Info

ID:	365046
PubChem CID:	127316725
Reduced:	ON2C16H22 (1)
Stoich.:	AB2C16D22 (1)
Weight, g/mol:	347.220892
ΔH_f, kcal/mol:	-31.37
Dipole, Da:	4.6
IP(EA), eV:	-8.73(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CN2CCCC2CN1C(=O)C3=CC=CC(=C3)C

DOS

IR

Vibrations