Geometry & MOs

Info

ID:	246154
PubChem CID:	103047056
Reduced:	ClFBr2O2H12C15 (1)
Stoich.:	ABC2D2E12F15 (1)
Weight, g/mol:	317.978126
ΔH_f, kcal/mol:	-83.03
Dipole, Da:	1.13
IP(EA), eV:	-9.18(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C(=CC(=C1)CBr)Br)OCC2=C(C=CC(=C2)Cl)F

DOS

IR

Vibrations