Geometry & MOs

Info

ID:	372258
PubChem CID:	131294752
Reduced:	BrClIOF2H5C8 (1)
Stoich.:	ABCDE2F5G8 (1)
Weight, g/mol:	441.76994
ΔH_f, kcal/mol:	-115.07
Dipole, Da:	2.18
IP(EA), eV:	-9.75(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-(bromomethyl)-1-(difluoromethoxy)-3-iodobenzene

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations