Geometry & MOs

Info

ID:	336790
PubChem CID:	127255797
Reduced:	Cl2F2H4C7 (1)
Stoich.:	A2B2C4D7 (1)
Weight, g/mol:	317.86896
ΔH_f, kcal/mol:	-89.46
Dipole, Da:	2.34
IP(EA), eV:	-10.09(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-3-(bromomethyl)-2-(trifluoromethyl)benzene

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1CCl)Cl)F)F

DOS

IR

Vibrations