Geometry & MOs

Info

ID:

376404

PubChem CID:

134222417

Reduced:

O4F8H32C33 (1)

Stoich.:

A4B8C32D33 (1)

Weight, g/mol:

646.155433

ΔHf, kcal/mol:

-524.14

Dipole, Da:

8.32

IP(EA), eV:

 -9.46(-1.07)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[[3,5-difluoro-4-(fluoromethoxy)phenoxy]-difluoromethyl]-1,3-difluoro-5-[2-fluoro-4-[2-fluoro-4-(4-propylphenyl)phenyl]phenyl]benzene

Drug info:

PubChemData

Smile

CCCC1COC(OC1)C2CCC(CC2)C3=CC(=C(C(=C3)F)C(OC4=CC(=C(C=C4)C5=CC(=C(C(=C5)F)OCF)F)F)(F)F)F

DOS

IR

Vibrations