Geometry & MOs

Info

ID:	203092
PubChem CID:	79777735
Reduced:	O2N3C9H15 (1)
Stoich.:	A2B3C9D15 (1)
Weight, g/mol:	234.111676
ΔH_f, kcal/mol:	-87.03
Dipole, Da:	4.22
IP(EA), eV:	-8.92(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-1-[(2-methylpyrimidin-4-yl)methyl]-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CN1CCC(CC1)N2CC(=O)NC2=O

DOS

IR

Vibrations