Geometry & MOs

Info

ID:	312939
PubChem CID:	126610208
Reduced:	FOC15H16 (2)
Stoich.:	ABC15D16 (2)
Weight, g/mol:	430.206343
ΔH_f, kcal/mol:	-125.45
Dipole, Da:	3.28
IP(EA), eV:	-8.6(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-[4-[(E)-pent-3-enyl]phenyl]-1-[[4-[(E)-pent-3-enyl]phenyl]methoxy]benzene

Drug info:

PubChemData

Smile

C/C=C/CCC1=CC=C(C=C1)C(OC2=CC=C(C=C2)COC3=CC=C(C=C3)CC/C=C/C)(F)F

DOS

IR

Vibrations