Geometry & MOs

Info

ID:	28719
PubChem CID:	829147
Reduced:	NO2C15H29 (1)
Stoich.:	AB2C15D29 (1)
Weight, g/mol:	320.152478
ΔH_f, kcal/mol:	-142.3
Dipole, Da:	2.53
IP(EA), eV:	-8.47(1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(11bS)-2-(2-phenylethyl)-3,6,7,11b-tetrahydropyrazino[2,1-a]isoquinoline-1,4-dione

Drug info:

PubChemData

Smile

CC(=O)O[C@H]1C[C@@H](CN(C1)C(C)(C)C)C(C)(C)C

DOS

IR

Vibrations