Geometry & MOs

Info

ID:	376366
PubChem CID:	134222378
Reduced:	OF10H16C22 (1)
Stoich.:	AB10C16D22 (1)
Weight, g/mol:	428.177471
ΔH_f, kcal/mol:	-486.46
Dipole, Da:	6.9
IP(EA), eV:	-9.68(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[difluoro-(4-propylcyclohexyl)methoxy]-2-fluoro-1-[3-fluoro-4-(fluoromethoxy)phenyl]benzene

Drug info:

PubChemData

Smile

C1CCC(CC1)C2=CC(=C(C=C2)C3=CC(=C(C(=C3)F)OC(/C(=C(/C(F)(F)F)\F)/F)(F)F)F)F

DOS

IR

Vibrations