Geometry & MOs

Info

ID:

376405

PubChem CID:

134222418

Reduced:

O2F9H23C35 (1)

Stoich.:

A2B9C23D35 (1)

Weight, g/mol:

588.114711

ΔHf, kcal/mol:

-413.87

Dipole, Da:

10.34

IP(EA), eV:

 -9.36(-1.21)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[[3,5-difluoro-4-(fluoromethoxy)phenoxy]-difluoromethyl]-5-[2,6-difluoro-4-(2-fluoro-4-propylphenyl)phenyl]-1,3-difluorobenzene

Drug info:

PubChemData

Smile

CCCC1=CC=C(C=C1)C2=CC(=C(C=C2)C3=CC(=C(C=C3)C4=CC(=C(C(=C4)F)C(OC5=CC(=C(C(=C5)F)OCF)F)(F)F)F)F)F

DOS

IR

Vibrations