Geometry & MOs

Info

ID:	89328
PubChem CID:	49960526
Reduced:	NBr2O2H9C12 (2)
Stoich.:	AB2C2D9E12 (2)
Weight, g/mol:	462.179087
ΔH_f, kcal/mol:	-55.38
Dipole, Da:	3.43
IP(EA), eV:	-9.21(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methoxyphenoxy)-1-[4-[2-(2-methoxyphenoxy)acetyl]-2,3-dihydroquinoxalin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CN(C2=CC=CC=C2N1C(=O)COC3=C(C=C(C=C3)Br)Br)C(=O)COC4=C(C=C(C=C4)Br)Br

DOS

IR

Vibrations