Geometry & MOs

Info

ID:	221025
PubChem CID:	85256149
Reduced:	N2O4C11H16 (1)
Stoich.:	A2B4C11D16 (1)
Weight, g/mol:	242.126657
ΔH_f, kcal/mol:	-160.39
Dipole, Da:	2.8
IP(EA), eV:	-9.99(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl 2-(5-methyl-2,4-dioxo-1,3-diazinan-1-yl)acetate

Drug info:

PubChemData

Smile

CCCOC(=O)C=CC(=O)N1CCNC(=O)C1

DOS

IR

Vibrations