Information card for entry 1507135

Structure parameters

• Formula: B1.89 Cl2.11 H16 K2 Zn
• Calculated formula: B1.876 Cl2.124 H16 K2 Zn
• Title of publication: Potassium Zinc Borohydrides Containing Triangular [Zn(BH4)3]−and Tetrahedral [Zn(BH4)xCl4‒x]2‒Anions
• Authors of publication: Černý, Radovan; Ravnsbæk, Dorthe B.; Schouwink, Pascal; Filinchuk, Yaroslav; Penin, Nicolas; Teyssier, Jeremie; Smrčok, L'ubomír; Jensen, Torben R.
• Journal of publication: The Journal of Physical Chemistry C
• Year of publication: 2012
• Journal volume: 116
• Journal issue: 1
• Pages of publication: 1563
• a: 12.3628 ± 0.0038 Å
• b: 9.1099 ± 0.0025 Å
• c: 7.3394 ± 0.0024 Å
• α: 90°
• β: 95.737 ± 0.024°
• γ: 90°
• Cell volume: 822.5 ± 0.4 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor R(I) for significantly intense reflections: 1.76
• Method of determination: powder diffraction
• Diffraction radiation wavelength: 0.72846 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No