Geometry & MOs

Info

ID:	312959
PubChem CID:	126610394
Reduced:	OC28H30 (1)
Stoich.:	AB28C30 (1)
Weight, g/mol:	426.272279
ΔH_f, kcal/mol:	30.96
Dipole, Da:	1.25
IP(EA), eV:	-8.49(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-but-3-enylphenyl)-2-fluoro-1-[4-[4-[(E)-pent-3-enyl]phenyl]butyl]benzene

Drug info:

PubChemData

Smile

C/C=C/CCC1=CC=C(C=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)CCC=C

DOS

IR

Vibrations