Geometry & MOs

Info

ID:	368610
PubChem CID:	127329643
Reduced:	O2N4C23H34 (1)
Stoich.:	A2B4C23D34 (1)
Weight, g/mol:	345.205242
ΔH_f, kcal/mol:	-85.52
Dipole, Da:	3.83
IP(EA), eV:	-8.6(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-yl)-3-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)propanamide

Drug info:

PubChemData

Smile

CC1CN2CCCCC2CN1CC(=O)NCC3=CC=CC=C3CN4CCCC4=O

DOS

IR

Vibrations