Geometry & MOs

Info

ID:	374515
PubChem CID:	131330731
Reduced:	O3C12H14 (1)
Stoich.:	A3B12C14 (1)
Weight, g/mol:	239.01539
ΔH_f, kcal/mol:	-124.94
Dipole, Da:	2.67
IP(EA), eV:	-8.98(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-2-nitro-6-(trifluoromethoxy)-1H-pyridin-4-one

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC(=CC2=C1CCC2)O

DOS

IR

Vibrations