Geometry & MOs

Info

ID:	150499
PubChem CID:	53790191
Reduced:	OC12H22 (1)
Stoich.:	AB12C22 (1)
Weight, g/mol:	578.349086
ΔH_f, kcal/mol:	-67.46
Dipole, Da:	2.13
IP(EA), eV:	-9.09(1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-2-fluoro-4-[2-[2-fluoro-4-[2-[4-[2-(4-octylphenyl)ethyl]cyclohexyl]ethyl]phenyl]ethyl]benzene

Drug info:

PubChemData

Smile

CC(=CCCC(=CCCCO)C)C

DOS

IR

Vibrations