Geometry & MOs

Info

ID:	147173
PubChem CID:	53786826
Reduced:	O4C13H18 (1)
Stoich.:	A4B13C18 (1)
Weight, g/mol:	564.288717
ΔH_f, kcal/mol:	-166.39
Dipole, Da:	7.58
IP(EA), eV:	-8.8(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-[2-fluoro-4-[4-(6-prop-2-enylperoxyhexoxy)phenyl]phenyl]phenoxy]hexyl formate

Drug info:

PubChemData

Smile

CCOC1=CC=CC(=C1OCC)CCC(=O)O

DOS

IR

Vibrations