Geometry & MOs

Info

ID:	312961
PubChem CID:	126610408
Reduced:	FC29H31 (1)
Stoich.:	AB29C31 (1)
Weight, g/mol:	412.256629
ΔH_f, kcal/mol:	8.98
Dipole, Da:	1.01
IP(EA), eV:	-8.93(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoro-1-[(E)-pent-3-enyl]-4-[4-[2-[4-[(E)-pent-3-enyl]phenyl]ethyl]phenyl]benzene

Drug info:

PubChemData

Smile

C/C=C/CCC1=CC=C(C=C1)C2=CC=C(C=C2)CCC3=C(C=C(C=C3)CCC=C)F

DOS

IR

Vibrations