Geometry & MOs

Info

ID:	233337
PubChem CID:	89850273
Reduced:	O3F11H23C25 (1)
Stoich.:	A3B11C23D25 (1)
Weight, g/mol:	548.140926
ΔH_f, kcal/mol:	-674.75
Dipole, Da:	9.25
IP(EA), eV:	-10.06(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[4-[difluoro-(4-propylcyclohexyl)methoxy]-2-fluorophenyl]-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)OC(F)(F)F)F)(F)F)F)(F)F

DOS

IR

Vibrations