Geometry & MOs

Info

ID:	437757
PubChem CID:	135226986
Reduced:	BrFOSH10C13 (1)
Stoich.:	ABCDE10F13 (1)
Weight, g/mol:	295.96706
ΔH_f, kcal/mol:	-23.48
Dipole, Da:	5.69
IP(EA), eV:	-8.64(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-1-fluoro-4-(4-methylphenyl)sulfanylbenzene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)C2=CC(=C(C=C2)F)Br

DOS

IR

Vibrations