Geometry & MOs

Info

ID:	165847
PubChem CID:	74604317
Reduced:	NO3C10H19 (1)
Stoich.:	AB3C10D19 (1)
Weight, g/mol:	222.064057
ΔH_f, kcal/mol:	-148.93
Dipole, Da:	8.67
IP(EA), eV:	-9.21(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3,8-dioxo-2,5,6,7-tetrahydroquinoxaline-2-carboxylate

Drug info:

PubChemData

Smile

CCC(C)(C(=O)[O-])[NH2+]CC1CCCO1

DOS

IR

Vibrations