Abstract: | Unusual H-Bonds in Sodium Hydroxide Monohydrate: X-Ray and Neutron Diffraction on NaOH · H2O and NaOD · D2O, respectively X-ray data revealed the structure of NaOH · H2O including the H positions. Neutron diffraction on microcrystalline NaOD · D2O was used for comparison of H with D positions: The compound crystallizes in a layer-type structure with the sequence …? /O Na O O Na O/ …? closely related to that of hydrargillite Al(OH)3 with …? /O 2/3 Al O O 2/3 Al O/ …?. Between OH? ions as acceptors and H2O molecules mäandric, one-dimensional infinite strong H-bonds occur with d(O…?O) = 2.66 Å and 2.69 Å. These lie within O-layers that coordinate Na+ ions. Bridge-bonds between OH? ions as donors and H2O molecules as acceptors connect the /O Na O/-layers with d(O…?O) = 3.18 Å. |