Geometry & MOs

Info

ID:	13428
PubChem CID:	231713
Reduced:	O2H9C13 (2)
Stoich.:	A2B9C13 (2)
Weight, g/mol:	394.120509
ΔH_f, kcal/mol:	-49.51
Dipole, Da:	3.59
IP(EA), eV:	-9.03(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-hydroxyphenyl)-3-(4-phenoxyphenyl)-2-benzofuran-1-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OC2=CC=C(C=C2)C3(C4=CC=CC=C4C(=O)O3)C5=CC=C(C=C5)O

DOS

IR

Vibrations