Geometry & MOs

Info

ID:	272149
PubChem CID:	103728128
Reduced:	NO2C13H27 (1)
Stoich.:	AB2C13D27 (1)
Weight, g/mol:	260.155849
ΔH_f, kcal/mol:	-137.37
Dipole, Da:	2.87
IP(EA), eV:	-9.12(0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-ethylsulfonylethyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine

Drug info:

PubChemData

Smile

CCCCC(CCC)NC(C)C(=O)OCC

DOS

IR

Vibrations