Geometry & MOs

Info

ID:	221105
PubChem CID:	85256828
Reduced:	OC19H32 (1)
Stoich.:	AB19C32 (1)
Weight, g/mol:	277.06987
ΔH_f, kcal/mol:	-66.65
Dipole, Da:	2.3
IP(EA), eV:	-9.24(1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(6-nitro-3-oxo-2H-quinoxalin-2-yl)acetate

Drug info:

PubChemData

Smile

CCCCCCC=CC(C1=C(CCCC1)CCC=C)O

DOS

IR

Vibrations