Geometry & MOs

Info

ID:	225513
PubChem CID:	85852667
Reduced:	FH5C6 (5)
Stoich.:	AB5C6 (5)
Weight, g/mol:	480.187642
ΔH_f, kcal/mol:	-175.74
Dipole, Da:	2.74
IP(EA), eV:	-9.49(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[4-(2,3-difluoro-4-propylphenyl)-3-fluorophenyl]phenyl]-2,3-difluoro-4-propylbenzene

Drug info:

PubChemData

Smile

CCCC1=C(C(=C(C=C1)C2=C(C=C(C=C2)C3=CC=C(C=C3)C4=CC(=C(C(=C4)F)CCC)F)F)F)F

DOS

IR

Vibrations