Geometry & MOs

Info

ID:	53919
PubChem CID:	14718386
Reduced:	NO2C6H9 (2)
Stoich.:	AB2C6D9 (2)
Weight, g/mol:	248.116092
ΔH_f, kcal/mol:	-202.22
Dipole, Da:	5.04
IP(EA), eV:	-10.4(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclohexa-1,3-dien-1-yl-5-ethyl-1-methyl-1,3-diazinane-2,4,6-trione

Drug info:

PubChemData

Smile

CCCC1(C(=O)NC(=O)NC1=O)CCCC(=O)C

DOS

IR

Vibrations