Syntheses and Crystal Structures of Sr7H12X2 (X = Cl, Br)
Dichroic, pink to blue single crystals of Sr7H12Cl2 and Sr7H12Br2 were obtained by reacting Sr with SrX2 or NaX and NaNH2 or NH4X (X = Cl, Br) as hydrogen sources in a Na melt at 900 °C for 12 h in silica-jacketed stainless-steel or Ta ampoules. The crystal structures of the new compounds were determined by means of single crystal X-ray diffraction. Both title compounds crystallize isotypically to Ba7Cl2F12 in the hexagonal space group P6̅ (no. 174) with the lattice parameters a = 998.06(3), c = 392.84(3) pm for Sr7H12Cl2 and a = 1004.62(3), c = 399.68(3) pm for Sr7H12Br2. The hydride positions taken from the difference Fourier map agree with those of the fluorides of the isotypic compound Ba7F12Cl12. The validity of our structural results is corroborated by EUTAX calculations and the comparison to SrH2, SrX2 and SrHX.