Geometry & MOs

Info

ID:	26166
PubChem CID:	639747
Reduced:	HOC2 (4)
Stoich.:	ABC2 (4)
Weight, g/mol:	309.121237
ΔH_f, kcal/mol:	-122.02
Dipole, Da:	6.07
IP(EA), eV:	-10.33(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-ethoxycyclohexa-1,4-dien-1-yl)-4-hydroxy-2,2-dimethyl-6-oxo-1,3-dioxine-5-carboxamide

Drug info:

PubChemData

Smile

C1=CC2=C(C=C1O)C(=O)OC2=O

DOS

IR

Vibrations