Geometry & MOs

Info

ID:	376364
PubChem CID:	134222376
Reduced:	OF3C22H25 (1)
Stoich.:	AB3C22D25 (1)
Weight, g/mol:	356.159929
ΔH_f, kcal/mol:	-170.03
Dipole, Da:	3.42
IP(EA), eV:	-9.01(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCC1=CC=C(C=C1)C2CCC(CC2)C3=CC(=C(C(=C3)F)OCF)F

DOS

IR

Vibrations