Geometry & MOs

Info

ID:	197790
PubChem CID:	78996969
Reduced:	NO2C18H25 (1)
Stoich.:	AB2C18D25 (1)
Weight, g/mol:	329.096476
ΔH_f, kcal/mol:	-65.06
Dipole, Da:	2.04
IP(EA), eV:	-8.49(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-chloropyridin-3-yl)sulfonyl-3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine

Drug info:

PubChemData

Smile

CC1CC2=CC(=C(C=C2O1)CNC3CC4CCC3C4)OC

DOS

IR

Vibrations