Geometry & MOs

Info

ID:	312952
PubChem CID:	126610364
Reduced:	FC14H14 (2)
Stoich.:	AB14C14 (2)
Weight, g/mol:	420.206485
ΔH_f, kcal/mol:	-27.96
Dipole, Da:	2.69
IP(EA), eV:	-9.05(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-but-3-enyl-4-[2-[4-(4-but-3-enylphenyl)-2-fluorophenyl]ethyl]-2,3-difluorobenzene

Drug info:

PubChemData

Smile

C=CCCC1=CC=C(C=C1)C2=CC(=C(C=C2)CCC3=CC(=C(C=C3)CCC=C)F)F

DOS

IR

Vibrations