Geometry & MOs

Info

ID:	17127
PubChem CID:	484968
Reduced:	ClO2H6C10 (2)
Stoich.:	AB2C6D10 (2)
Weight, g/mol:	386.011264
ΔH_f, kcal/mol:	-103.23
Dipole, Da:	4.98
IP(EA), eV:	-9.37(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-bis(3-chloro-4-hydroxyphenyl)-2-benzofuran-1-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)OC2(C3=CC(=C(C=C3)O)Cl)C4=CC(=C(C=C4)O)Cl

DOS

IR

Vibrations