Geometry & MOs

Info

ID:	246155
PubChem CID:	103047074
Reduced:	FOCl3H10C14 (1)
Stoich.:	ABC3D10E14 (1)
Weight, g/mol:	302.007677
ΔH_f, kcal/mol:	-65.66
Dipole, Da:	3.01
IP(EA), eV:	-9.68(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-chloro-2-fluorophenyl)methoxy]-1-(chloromethyl)-3-fluorobenzene

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)OCC2=C(C=CC(=C2)Cl)F)CCl

DOS

IR

Vibrations