Geometry & MOs

Info

ID:	23344
PubChem CID:	603153
Reduced:	BrO3H8C12 (2)
Stoich.:	AB3C8D12 (2)
Weight, g/mol:	559.92931
ΔH_f, kcal/mol:	-142.08
Dipole, Da:	1.39
IP(EA), eV:	-10.05(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

bis[2-(4-bromophenyl)-2-oxoethyl] benzene-1,3-dicarboxylate

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)C(=O)OCC(=O)C2=CC=C(C=C2)Br)C(=O)OCC(=O)C3=CC=C(C=C3)Br

DOS

IR

Vibrations