Geometry & MOs

Info

ID:	204202
PubChem CID:	79931307
Reduced:	ON6C12H20 (1)
Stoich.:	AB6C12D20 (1)
Weight, g/mol:	252.183778
ΔH_f, kcal/mol:	3.06
Dipole, Da:	2.82
IP(EA), eV:	-8.9(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)pentane-1,4-dione

Drug info:

PubChemData

Smile

CC1CN2CCCCC2CN1C(=O)C3=NC(=NN3)N

DOS

IR

Vibrations