Geometry & MOs

Info

ID:	216269
PubChem CID:	85085969
Reduced:	N2O2H4C5 (2)
Stoich.:	A2B2C4D5 (2)
Weight, g/mol:	248.116092
ΔH_f, kcal/mol:	54.71
Dipole, Da:	10.66
IP(EA), eV:	-9.9(-2.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)propanoate

Drug info:

PubChemData

Smile

CC(=O)NC1=NC2=NC(=O)C(=CC2C=C1)[N+](=O)[O-]

DOS

IR

Vibrations