Geometry & MOs

Info

ID:	200805
PubChem CID:	79446874
Reduced:	F2Br3H13C16 (1)
Stoich.:	A2B3C13D16 (1)
Weight, g/mol:	453.87246
ΔH_f, kcal/mol:	-51.17
Dipole, Da:	2.31
IP(EA), eV:	-9.61(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-bromo-2-(bromomethyl)-2-(2-fluorophenyl)propyl]-1,4-dichlorobenzene

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(CC2=C(C=CC(=C2)F)Br)(CBr)CBr)F

DOS

IR

Vibrations