Geometry & MOs

Info

ID:	376279
PubChem CID:	134222289
Reduced:	FOC15H15 (1)
Stoich.:	ABC15D15 (1)
Weight, g/mol:	338.112979
ΔH_f, kcal/mol:	-59.06
Dipole, Da:	1.98
IP(EA), eV:	-8.85(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[3,5-difluoro-4-(fluoromethoxy)phenyl]phenyl]-5-methyl-1,3-dioxane

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C2=CC=C(C=C2)OCF

DOS

IR

Vibrations