Geometry & MOs

Info

ID:	295449
PubChem CID:	117529422
Reduced:	ON3C15H21 (1)
Stoich.:	AB3C15D21 (1)
Weight, g/mol:	259.168462
ΔH_f, kcal/mol:	-20.88
Dipole, Da:	3.46
IP(EA), eV:	-8.77(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-7-(4-methylphenyl)-3,4,7,8,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-6-one

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2C(=O)N3CCN(CC3CN2)C

DOS

IR

Vibrations