Geometry & MOs

Info

ID:	20659
PubChem CID:	585034
Reduced:	N2O4C21H22 (1)
Stoich.:	A2B4C21D22 (1)
Weight, g/mol:	366.157957
ΔH_f, kcal/mol:	-137.64
Dipole, Da:	1.85
IP(EA), eV:	-8.93(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-ethoxyphenyl)methyl]-1-(4-ethylphenyl)-1,3-diazinane-2,4,6-trione

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=O)CC3=CC=C(C=C3)OCC

DOS

IR

Vibrations