Geometry & MOs

Info

ID:	19405
PubChem CID:	563152
Reduced:	F2O7H38C43 (1)
Stoich.:	A2B7C38D43 (1)
Weight, g/mol:	704.25856
ΔH_f, kcal/mol:	-207.66
Dipole, Da:	5.97
IP(EA), eV:	-8.62(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-bis[2-fluoro-4,5-bis(phenylmethoxy)phenoxy]propan-2-ol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=CC(=C(C=C2OCC3=CC=CC=C3)F)OCC(COC4=C(C=C(C(=C4)OCC5=CC=CC=C5)OCC6=CC=CC=C6)F)O

DOS

IR

Vibrations