Geometry & MOs

Info

ID:	177636
PubChem CID:	76207014
Reduced:	NO3C15H21 (1)
Stoich.:	AB3C15D21 (1)
Weight, g/mol:	240.183778
ΔH_f, kcal/mol:	-82.41
Dipole, Da:	1.94
IP(EA), eV:	-8.96(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-tert-butyl-2-(oxan-4-yl)-1,3-diazinan-4-one

Drug info:

PubChemData

Smile

CCC(=NO)C1=CC=CC=C1OCC2CCOCC2

DOS

IR

Vibrations