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Crystal structure of samarium-strontium-calcium orthoaluminotantalate, (Sm0.40Sr0.50Ca0.10)(Al0.70Ta 0.30)O3

2010, Gesing, T.M., Uecker, R., Zheng, W., Buhl, J.-C.

Al2.90Ca0.45O12Sm 1.59Sr2Ta1.10, tetragonal, I4 (no. 82), a = 5.4174(8) Å, c = 7.643(2) Å, V = 224.3 Å3, Z = 1, Rgt(F) = 0.039, wRref(F 2) = 0.1258 , T = 298 K. © 2014 Oldenbourg Wissenschaftsverlag, München.

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Crystal structure of 1-bis(((1R,2S,5R)-2-isopropyl-5-methylcyclohexyl) cyclopentadienyl)-1-trimethylphosphine-2,3-bis(trimethylsilyl) -1-hafnacycloprop-2-ene-hexane (1:0.5), (HfC8H18Si 2)(C15H22)2(PC3H 9) · 0.5C6H14

2010, Klahn, M., Spannenberg, A., Rosenthal, U.

C44H78HfPSi2, tetragonal, P4 1212 (no. 92), a = 14.9634(2) Å, c = 44.9270(8) Å, V = 10059.3 Å3, Z = 8, Rgt(F) = 0.026, wRref(F2) = 0.073, T = 200 K. © by Oldenbourg Wissenschaftsverlag, München.

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Ba3YRu0.73(2)Al1.27(2)O8 and Ba5Y2Ru1.52(2)Al1.47(2)O 13.5: New perovskite ruthenates with partial octahedra replacement

2014, Schüpp-Niewa, Barbara, Shlyk, Larysa, Prots, Yurii, Krabbes, Gernot, Niewa, Rainer

Dark red single crystals of the new phases Ba3YRu0.73(2)Al1.27(2)O8 and Ba5Y2Ru1.52(2)Al1.47(2)O13.5 have been grown from powder mixtures of BaCO3, Y2O3, Al2O3, and RuO2 . The compositions given in the formulas result from the refinements of the crystal structures based on single crystal X-ray diffraction data (hexagonal P63/mmc (No. 194), Z = 2, Ba3 YRu0.73(2)Al1.27(2)O8: a = 5.871(1), c = 14.633(3) Å , R1 = 0.035, wR2 = 0.069 and Ba5Y2Ru1.52(2)Al1.47(2)O13.5: a = 5.907(1), c = 24.556(5) Å, R1 = 0.057, wR2 = 0.114). Ba3YRu0.73(2)Al1.27(2)O8 crystallizes in a 6H perovskite structure, Ba5Y2Ru1.52(2)Al1.47(2)O13.5 has been characterized as a 10H Perovskite. Due to similar spatial extensions of (Ru2O9) facesharing pairs of octahedra and (Al2O7) vertex-sharing pairs of tetrahedra, both structures show partial mutual substitution of these units. Consequently, the title compounds may be written as Ba3Y(Ru2O9)1−x(Al2O7)x, x = 0.64(1) and Ba5Y2RuO6(Ru2O9)1−x(Al2O7)x, x = 0.74(1). This interpretation is supported by the results of electron probe microanalysis using wavelength-dispersive X-ray spectroscopy. An oxidation state of Ru close to +5 for the (Ru2O9) units, as can be derived from the distances d(Ru-Ru), additionally leads to similar charges of both the (Ru2O9) and the (Al2O7) units.

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Crystal structure of bis(pentamethylcyclopentadienyl)(1-tert- butylisocyanido)-2-trimethylsilyl-3-[(trimethylsilyl)ethynyl]-hafnacyclopropene, (C10H15)2(C5H9N) Hf(C10H18Si2)

2010, Beweries, T., Spannenberg, A., Rosenthal, U.

C35H57HfNSi2, monoclinic, P121/c1 (no. 14), a = 10.7410(3) Å, b = 16.2302(5) Å, c = 21.6945(7) Å, β = 104.512(2)°, V = 3661.3 Å3, Z = 4, R gt(F) = 0.049, wRref(F2) = 0.138, T = 200 K. © 2014 Oldenbourg Wissenschaftsverlag, München.

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Crystal structure of bis(pentamethylcyclopentadienyl)-(4,4′-di-tert- butylbipyridyl)hafnium(IV)-hexane (1:0.5), Hf(C10H15) 2(C18H24N2) · 0.5C 6H14

2010, Beweries, T., Spannenberg, A., Rosenthal, U.

C41H61HfN2, monoclinic, P21/n (no. 14), a = 13.4410(4) Å, b = 13.9983(6) Å, c = 21.1996(8) Å, β = 98.144(3)°, V = 3948.5 Å3, Z = 4, Rgt(F) = 0.051, wRref(F2) = 0.121,T = 200 K. © 2014 Oldenbourg Wissenschaftsverlag, München.