Geometry & MOs

Info

ID:	194204
PubChem CID:	78497085
Reduced:	SN2O3C10H18 (1)
Stoich.:	AB2C3D10E18 (1)
Weight, g/mol:	274.135114
ΔH_f, kcal/mol:	-144.0
Dipole, Da:	1.85
IP(EA), eV:	-8.96(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(1,3-dioxan-2-yl)ethylsulfanyl]-6-ethyl-1,3-diazinan-4-one

Drug info:

PubChemData

Smile

CCC1CC(=O)NC(N1)SCC2OCCO2

DOS

IR

Vibrations