Geometry & MOs

Info

ID:	216587
PubChem CID:	85086461
Reduced:	N2F3O5C9H11 (1)
Stoich.:	A2B3C5D9E11 (1)
Weight, g/mol:	282.038905
ΔH_f, kcal/mol:	-276.66
Dipole, Da:	7.77
IP(EA), eV:	-11.08(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-nitro-7-pyridin-3-ylquinoxaline-2,3-dione

Drug info:

PubChemData

Smile

COC(=O)C(CC1CC1[N+](=O)[O-])NC(=O)C(F)(F)F

DOS

IR

Vibrations