Geometry & MOs

Info

ID:	586
PubChem CID:	3037
Reduced:	Cl2O2H10C13 (1)
Stoich.:	A2B2C10D13 (1)
Weight, g/mol:	268.005785
ΔH_f, kcal/mol:	-68.09
Dipole, Da:	3.85
IP(EA), eV:	-8.91(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-[(5-chloro-2-hydroxyphenyl)methyl]phenol

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)CC2=C(C=CC(=C2)Cl)O)O

DOS

IR

Vibrations