Geometry & MOs

Info

ID:	3581
PubChem CID:	9817
Reduced:	BrF3H4C7 (1)
Stoich.:	AB3C4D7 (1)
Weight, g/mol:	223.94485
ΔH_f, kcal/mol:	-136.13
Dipole, Da:	2.85
IP(EA), eV:	-10.15(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-3-(trifluoromethyl)benzene

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations