Geometry & MOs

Info

ID:	431477
PubChem CID:	135171558
Reduced:	BrFOH6C12 (1)
Stoich.:	ABCD6E12 (1)
Weight, g/mol:	234.085621
ΔH_f, kcal/mol:	-19.22
Dipole, Da:	3.39
IP(EA), eV:	-9.28(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-difluoro-2-(2-methoxyphenyl)-5-methylbenzene

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(O2)C(=C(C=C3)F)Br

DOS

IR

Vibrations