Geometry & MOs

Info

ID:	191723
PubChem CID:	78181677
Reduced:	N2F3O4C11H11 (1)
Stoich.:	A2B3C4D11E11 (1)
Weight, g/mol:	225.074956
ΔH_f, kcal/mol:	-306.56
Dipole, Da:	3.69
IP(EA), eV:	-10.36(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-methyl-5-oxo-2H-pyran-2-yl)-1,2,4-triazinane-3,5-dione

Drug info:

PubChemData

Smile

CC1C(=O)C=CC(O1)N2CC(C(=O)NC2=O)C(F)(F)F

DOS

IR

Vibrations