Geometry & MOs

Info

ID:	182452
PubChem CID:	76890971
Reduced:	OBr2N2H8C14 (1)
Stoich.:	AB2C2D8E14 (1)
Weight, g/mol:	453.88139
ΔH_f, kcal/mol:	65.74
Dipole, Da:	6.28
IP(EA), eV:	-9.31(-2.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[bromo-(4-iodophenyl)methyl]quinoxaline-2,3-dione

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(=C2C=CC3=NC(=O)NC3=C2)Br)Br

DOS

IR

Vibrations