Geometry & MOs

Info

ID:	295455
PubChem CID:	117529547
Reduced:	N3C12H25 (1)
Stoich.:	A3B12C25 (1)
Weight, g/mol:	261.147727
ΔH_f, kcal/mol:	-16.96
Dipole, Da:	1.33
IP(EA), eV:	-8.5(2.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-methoxyphenyl)-1,2,4,6,7,8,9,9a-octahydropyrazino[1,2-a]pyrazin-3-one

Drug info:

PubChemData

Smile

CC(C)CC1CN2CCN(CC2CN1)C

DOS

IR

Vibrations