Geometry & MOs

Info

ID:	53593
PubChem CID:	14716846
Reduced:	FO3C30H43 (1)
Stoich.:	AB3C30D43 (1)
Weight, g/mol:	504.303973
ΔH_f, kcal/mol:	-204.41
Dipole, Da:	3.52
IP(EA), eV:	-8.96(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclohexyloxy-4-[[4-[4-(2-fluorooctoxy)phenyl]phenoxy]methyl]benzene

Drug info:

PubChemData

Smile

CCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)CC(C)(CC)F

DOS

IR

Vibrations