Geometry & MOs

Info

ID:	263766
PubChem CID:	103396479
Reduced:	FOBr2C13H17 (1)
Stoich.:	ABC2D13E17 (1)
Weight, g/mol:	451.82453
ΔH_f, kcal/mol:	-91.15
Dipole, Da:	2.72
IP(EA), eV:	-9.49(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-5-[bromo-(4-bromophenyl)methyl]-2-fluoro-4-methoxybenzene

Drug info:

PubChemData

Smile

CC(C)(C)CC(C1=CC(=C(C=C1OC)F)Br)Br

DOS

IR

Vibrations