Geometry & MOs

Info

ID:	207340
PubChem CID:	80382189
Reduced:	OSF2C14H14 (1)
Stoich.:	ABC2D14E14 (1)
Weight, g/mol:	349.97295
ΔH_f, kcal/mol:	-114.59
Dipole, Da:	5.1
IP(EA), eV:	-9.25(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-bromo-2-(3,4-difluorophenyl)ethyl]-1,3,5-trifluorobenzene

Drug info:

PubChemData

Smile

CC1=CC(=C(S1)C)C(CC2=CC(=C(C=C2)F)F)O

DOS

IR

Vibrations