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The spin-crossover (SCO) compounds [Fe(Htrz)3](BF4)2·H2O (SCO-1) and [Fe(Htrz)2trz]BF4 (SCO-2) (Htrz = 1,2,4-triazole) were embedded in the pores of mesostructured silica MCM-41 to yield SCO@MCM composites as evidenced by electron microscopy, gas sorption studies, powder X-ray diffractometry, atomic absorption and infrared spectrometry. Studies of the temperature-induced spin crossover behavior of the composites by temperature-variable 57Fe Mössbauer spectroscopy, magnetic and differential scanning calorimetry measurements and optical reflectivity indicate that the spin transition of the composites was significantly shifted for SCO-1@MCM to higher temperature in comparison to bulk SCO-1 compounds while the shift for SCO-2 was negligible. These shifts in the transition temperature for SCO-1@MCM [versus bulk SCO-1] amounted to T↑c = 371/376 K [282/291 K] and T↓c = 340/345 K [276/286 K] (magnetic/optical reflectivity data) with a broadening of the hysteresis by 25–26 K relative to bulk SCO-1 (varying slightly with the used method). The significant difference in the SCO behavior of the similar materials SCO-1 and SCO-2 when embedded in the MCM-41 matrix is assigned to the hydration of the SCO-1@MCM material. Water is apparently crucial in transmitting the confinement pressure or matrix effect on the spin transition when the SCO compound is embedded between the pore walls

Water effect on the spin-transition behavior of Fe(ii) 1,2,4-triazole 1D chains embedded in pores of MCM-41