Geometry & MOs

Info

ID:	13232
PubChem CID:	223555
Reduced:	ClOH13C14 (1)
Stoich.:	ABC13D14 (1)
Weight, g/mol:	232.065493
ΔH_f, kcal/mol:	-19.87
Dipole, Da:	3.48
IP(EA), eV:	-9.02(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(3-chlorophenyl)ethyl]phenol

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)O)CCC2=CC(=CC=C2)Cl

DOS

IR

Vibrations