Geometry & MOs

Info

ID:

376420

PubChem CID:

134222433

Reduced:

O4F8H26C33 (1)

Stoich.:

A4B8C26D33 (1)

Weight, g/mol:

612.302671

ΔHf, kcal/mol:

-480.95

Dipole, Da:

5.59

IP(EA), eV:

 -9.11(-1.28)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[difluoro-[3-fluoro-4-(fluoromethoxy)phenoxy]methyl]-2-fluoro-4-[4-[4-(4-pentylcyclohexyl)cyclohexen-1-yl]phenyl]benzene

Drug info:

PubChemData

Smile

CCCC1COC(OC1)C2=CC(=C(C=C2)C3=CC(=C(C(=C3)F)C(OC4=CC(=C(C=C4)C5=CC(=C(C=C5)OCF)F)F)(F)F)F)F

DOS

IR

Vibrations