Geometry & MOs

Info

ID:	376335
PubChem CID:	134222346
Reduced:	O2F5C23H29 (1)
Stoich.:	A2B5C23D29 (1)
Weight, g/mol:	436.203686
ΔH_f, kcal/mol:	-340.08
Dipole, Da:	5.44
IP(EA), eV:	-9.58(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[[3,5-difluoro-4-(fluoromethoxy)phenoxy]-difluoromethyl]cyclohexyl]-5-propyloxane

Drug info:

PubChemData

Smile

CCCC1CCC(CC1)C2CCC(=CC2)C(OC3=CC(=C(C(=C3)F)OCF)F)(F)F

DOS

IR

Vibrations