Geometry & MOs

Info

ID:	23338
PubChem CID:	603144
Reduced:	BrO2H5C8 (1)
Stoich.:	AB2C5D8 (1)
Weight, g/mol:	211.94729
ΔH_f, kcal/mol:	-47.17
Dipole, Da:	3.95
IP(EA), eV:	-10.32(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3H-2-benzofuran-1-one

Drug info:

PubChemData

Smile

C1C2=C(C=CC(=C2)Br)C(=O)O1

DOS

IR

Vibrations