Geometry & MOs

Info

ID:	24803
PubChem CID:	613725
Reduced:	BrO4H11C16 (1)
Stoich.:	AB4C11D16 (1)
Weight, g/mol:	345.98407
ΔH_f, kcal/mol:	-98.93
Dipole, Da:	5.76
IP(EA), eV:	-10.02(-1.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-1-hydroxy-3-oxo-2-phenylindene-1-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2(C(=O)C3=CC=CC=C3C2(C(=O)O)O)Br

DOS

IR

Vibrations