Geometry & MOs

Info

ID:	167747
PubChem CID:	74868635
Reduced:	SO2N5C10H17 (1)
Stoich.:	AB2C5D10E17 (1)
Weight, g/mol:	285.125946
ΔH_f, kcal/mol:	-33.46
Dipole, Da:	4.32
IP(EA), eV:	-9.48(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-2-[[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-1,3-diazinan-4-one

Drug info:

PubChemData

Smile

CC(C)C1=NOC(=N1)CSC2NC(CC(=O)N2)N

DOS

IR

Vibrations