Geometry & MOs

Info

ID:	321598
PubChem CID:	126666663
Reduced:	N2F3O4H5C8 (1)
Stoich.:	A2B3C4D5E8 (1)
Weight, g/mol:	288.12224
ΔH_f, kcal/mol:	-269.07
Dipole, Da:	6.34
IP(EA), eV:	-10.82(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyloxan-4-yl)-3-nitro-1,5-naphthyridin-4-amine

Drug info:

PubChemData

Smile

C1=C(N=CC(=N1)OC(=O)CC(=O)O)C(F)(F)F

DOS

IR

Vibrations