Geometry & MOs

Info

ID:	233333
PubChem CID:	89850269
Reduced:	O2F9H21C23 (1)
Stoich.:	A2B9C21D23 (1)
Weight, g/mol:	560.177312
ΔH_f, kcal/mol:	-515.68
Dipole, Da:	7.45
IP(EA), eV:	-9.83(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[4-[difluoro-(4-pentylcyclohexyl)methoxy]-2-fluorophenyl]-difluoromethoxy]-1,3-difluoro-2-(trifluoromethyl)benzene

Drug info:

PubChemData

Smile

CCCC1CCC(CC1)C(OC2=CC(=C(C(=C2)F)C(OC3=CC(=C(C(=C3)F)F)F)(F)F)F)(F)F

DOS

IR

Vibrations