Geometry & MOs

Info

ID:	20381
PubChem CID:	583626
Reduced:	NO2H6C8 (2)
Stoich.:	AB2C6D8 (2)
Weight, g/mol:	296.079707
ΔH_f, kcal/mol:	-93.85
Dipole, Da:	3.45
IP(EA), eV:	-9.2(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(furan-3-ylmethylidene)-1-(4-methylphenyl)-1,3-diazinane-2,4,6-trione

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C(=O)C(=CC3=COC=C3)C(=O)NC2=O

DOS

IR

Vibrations