Geometry & MOs

Info

ID:	354243
PubChem CID:	127286207
Reduced:	ON2C11H12 (2)
Stoich.:	AB2C11D12 (2)
Weight, g/mol:	393.181919
ΔH_f, kcal/mol:	-0.03
Dipole, Da:	1.6
IP(EA), eV:	-8.71(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-chloro-2-(oxolan-2-ylmethoxy)phenyl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCN2CCN(CC2C1)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4C#N

DOS

IR

Vibrations