Geometry & MOs

Info

ID:	89326
PubChem CID:	49960504
Reduced:	N2Br3O3H19C20 (1)
Stoich.:	A2B3C3D19E20 (1)
Weight, g/mol:	479.91433
ΔH_f, kcal/mol:	-18.03
Dipole, Da:	1.66
IP(EA), eV:	-9.07(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(5-bromofuran-2-carbonyl)-2,3-dihydroquinoxalin-1-yl]-(5-bromofuran-2-yl)methanone

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C(C=C1)OCC2=NN=C(O2)COC3=C(C=C(C=C3)Br)Br)Br

DOS

IR

Vibrations