Geometry & MOs

Info

ID:	376734
PubChem CID:	134222759
Reduced:	OF3C11H11 (2)
Stoich.:	AB3C11D11 (2)
Weight, g/mol:	450.142977
ΔH_f, kcal/mol:	-353.36
Dipole, Da:	8.32
IP(EA), eV:	-9.75(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[difluoro-(3,4,5-trifluorophenoxy)methyl]-5-[4-(ethoxymethyl)cyclohexyl]-1,3-difluorobenzene

Drug info:

PubChemData

Smile

CCOCC1CCC(CC1)C2=CC(=C(C=C2)C(OC3=CC(=C(C(=C3)F)F)F)(F)F)F

DOS

IR

Vibrations