Geometry & MOs

Info

ID:	126336
PubChem CID:	50960220
Reduced:	ON6C15H20 (1)
Stoich.:	AB6C15D20 (1)
Weight, g/mol:	346.24811
ΔH_f, kcal/mol:	26.44
Dipole, Da:	5.8
IP(EA), eV:	-8.85(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-ethyl-6-(8-methyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazin-2-yl)pyrimidin-2-yl]morpholine

Drug info:

PubChemData

Smile

CC1=CN=C(N=C1N(C)C)NCCNC(=O)C2=CC=NC=C2

DOS

IR

Vibrations