Geometry & MOs

Info

ID:	233335
PubChem CID:	89850271
Reduced:	O2F11H23C25 (1)
Stoich.:	A2B11C23D25 (1)
Weight, g/mol:	572.197298
ΔH_f, kcal/mol:	-640.76
Dipole, Da:	10.01
IP(EA), eV:	-10.43(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[4-[difluoro-(4-hexylcyclohexyl)methoxy]phenyl]-difluoromethoxy]-1,3-difluoro-2-(trifluoromethoxy)benzene

Drug info:

PubChemData

Smile

CCCCC1CCC(CC1)C(OC2=CC(=C(C(=C2)F)C(OC3=CC(=C(C(=C3)F)C(F)(F)F)F)(F)F)F)(F)F

DOS

IR

Vibrations