Geometry & MOs

Info

ID:	361026
PubChem CID:	127301910
Reduced:	SO2N3C16H23 (1)
Stoich.:	AB2C3D16E23 (1)
Weight, g/mol:	336.125612
ΔH_f, kcal/mol:	-59.79
Dipole, Da:	4.26
IP(EA), eV:	-8.92(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethyl]-2-(2,4-dioxo-1,3-diazinan-1-yl)acetamide

Drug info:

PubChemData

Smile

C1CSCC1(CNC(=O)CC2=CN=CC=C2)N3CCOCC3

DOS

IR

Vibrations