Geometry & MOs

Info

ID:

376815

PubChem CID:

134222841

Reduced:

OF4H12C14 (2)

Stoich.:

AB4C12D14 (2)

Weight, g/mol:

558.236877

ΔHf, kcal/mol:

-415.44

Dipole, Da:

4.79

IP(EA), eV:

-9.79(-1.04)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOCC1CCC(CC1)C2=C(C(=C(C=C2)C(OC3=C(C(=C(C=C3)C4=CC(=C(C=C4)F)F)F)F)(F)F)F)F

DOS

IR

Vibrations