Geometry & MOs

Info

ID:	368519
PubChem CID:	127329341
Reduced:	SO3N4C19H26 (1)
Stoich.:	AB3C4D19E26 (1)
Weight, g/mol:	379.225977
ΔH_f, kcal/mol:	-70.94
Dipole, Da:	6.27
IP(EA), eV:	-8.82(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3-methyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-3-oxopropyl]naphthalene-2-carboxamide

Drug info:

PubChemData

Smile

CC1CN2CCCCC2CN1C(=O)CN(C)S(=O)(=O)C3=CC=C(C=C3)C#N

DOS

IR

Vibrations