Geometry & MOs

Info

ID:	353117
PubChem CID:	127284297
Reduced:	OF2N7C17H19 (1)
Stoich.:	AB2C7D17E19 (1)
Weight, g/mol:	279.231063
ΔH_f, kcal/mol:	-26.92
Dipole, Da:	6.3
IP(EA), eV:	-9.36(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl-(1-ethylpiperidin-2-yl)methanone

Drug info:

PubChemData

Smile

CN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=NC=CN4C(F)F)N=N1

DOS

IR

Vibrations