Geometry & MOs

Info

ID:	354803
PubChem CID:	127287563
Reduced:	SO2N4C20H24 (1)
Stoich.:	AB2C4D20E24 (1)
Weight, g/mol:	378.263091
ΔH_f, kcal/mol:	-35.15
Dipole, Da:	4.85
IP(EA), eV:	-8.79(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-[2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-2-oxoethoxy]ethanone

Drug info:

PubChemData

Smile

C1CCN2CCN(CC2C1)C(=O)C3=CC=C(S3)NC(=O)NC4=CC=CC=C4

DOS

IR

Vibrations