Geometry & MOs

Info

ID:	148409
PubChem CID:	53788071
Reduced:	OC19H36 (1)
Stoich.:	AB19C36 (1)
Weight, g/mol:	444.258379
ΔH_f, kcal/mol:	-72.45
Dipole, Da:	2.24
IP(EA), eV:	-9.79(1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCC=CCC1CO1

DOS

IR

Vibrations