Geometry & MOs

Info

ID:	246168
PubChem CID:	103047773
Reduced:	ClFNOBr2H9C13 (1)
Stoich.:	ABCDE2F9G13 (1)
Weight, g/mol:	296.077949
ΔH_f, kcal/mol:	-44.85
Dipole, Da:	2.68
IP(EA), eV:	-9.56(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-chloro-2-fluorophenyl)-3-(4-fluorophenyl)-2-methylpropan-2-ol

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)CC(C2=C(C=C(C=N2)Br)Br)O)F

DOS

IR

Vibrations