Geometry & MOs

Info

ID:	89343
PubChem CID:	49960594
Reduced:	NO3H9C12 (2)
Stoich.:	AB3C9D12 (2)
Weight, g/mol:	330.085186
ΔH_f, kcal/mol:	-154.3
Dipole, Da:	10.83
IP(EA), eV:	-9.19(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-[4-[(E)-3-carboxyprop-2-enoyl]-2,3-dihydroquinoxalin-1-yl]-4-oxobut-2-enoic acid

Drug info:

PubChemData

Smile

C1CN(C2=CC=CC=C2N1C(=O)C3=CC=CC=C3C(=O)O)C(=O)C4=CC=CC=C4C(=O)O

DOS

IR

Vibrations