Geometry & MOs

Info

ID:	144934
PubChem CID:	53433655
Reduced:	BO3C23H25 (1)
Stoich.:	AB3C23D25 (1)
Weight, g/mol:	280.066636
ΔH_f, kcal/mol:	-149.09
Dipole, Da:	4.79
IP(EA), eV:	-8.4(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(4-chloro-3-fluorophenoxy)phenyl]propan-1-ol

Drug info:

PubChemData

Smile

B1(OC(CC(O1)(C)C)C)C2=C3C=CC=C(C3=CC=C2)OCC4=CC=CC=C4

DOS

IR

Vibrations