Geometry & MOs

Info

ID:	354215
PubChem CID:	127286179
Reduced:	FO2N4C20H23 (1)
Stoich.:	AB2C4D20E23 (1)
Weight, g/mol:	396.216141
ΔH_f, kcal/mol:	-69.37
Dipole, Da:	6.78
IP(EA), eV:	-8.69(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-(2-methoxy-4-methylphenoxy)pyridin-3-yl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCN2CCN(CC2C1)C(=O)NC3=CN=C(C=C3)OC4=CC=C(C=C4)F

DOS

IR

Vibrations