Geometry & MOs

Info

ID:	356015
PubChem CID:	127291044
Reduced:	SN2O4C18H26 (1)
Stoich.:	AB2C4D18E26 (1)
Weight, g/mol:	381.172228
ΔH_f, kcal/mol:	-153.23
Dipole, Da:	10.53
IP(EA), eV:	-9.6(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-methylsulfonylphenoxy)ethyl]-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine-2-carboxamide

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC=C(C=C1)OCCNC(=O)N2CCCC2C3CCC3

DOS

IR

Vibrations