Geometry & MOs

Info

ID:	40536
PubChem CID:	8144291
Reduced:	NO2C6H8 (3)
Stoich.:	AB2C6D8 (3)
Weight, g/mol:	377.158685
ΔH_f, kcal/mol:	-187.88
Dipole, Da:	10.88
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.919972
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-diethoxyphenyl)-3-(morpholin-4-ylmethyl)imidazolidine-2,4,5-trione

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)N2C(=O)C(=O)N(C2=O)C[NH+]3CCOCC3)OCC

DOS

IR

Vibrations