Geometry & MOs

Info

ID:	337220
PubChem CID:	127256785
Reduced:	BrO2H9C15 (1)
Stoich.:	AB2C9D15 (1)
Weight, g/mol:	204.078644
ΔH_f, kcal/mol:	8.14
Dipole, Da:	3.94
IP(EA), eV:	-9.52(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-6-hydroxy-2-(2-methylpropylidene)-1-benzofuran-3-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)/C(=C\C3=CC=C(C=C3)Br)/O2

DOS

IR

Vibrations