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35648977747
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Crystal data for 22·FeBr4: C 22H12O2S8Se8FeBr 4, M, 1571.96, monoclinic, a, 14.428(9) Å b, 13.924(9) Å, c, 19.35(1) Å, β, 100.15(3)°, V, 3825(4) Å3, T, 296 K, space group P21/a, Z, 4, μ(Mo Kα, 12.659 cm -1, 75 606 reflections measured (Rint, 0.108, 8740 unique, of which 5682 were used in all calculations [F2 > 2.00σF2, The final R and Rw were 0.038 and 0.053, respectively
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2)]. The final R and Rw were 0.038 and 0.053, respectively.
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12
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35648992108
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Crystal data for 22·GaBr4: C 22H12O2S8Se8GaBr 4, M, 1585.83, monoclinic, a, 14.4459(5) Å b, 13.9377(4) Å c, 19.3784(6) Å, β, 100.1070(9)°, V, 3841.2(2) Å3, T, 296 K, space group P21/a, Z, 4, μ(Mo Kα, 12.933 cm-1, 74 014 reflections measured (Rint, 0.129, 8694 unique, of which 4003 were used in all calculations [F2 > 2.00σF2, The final R and Rw were 0.037 and 0.046, respectively
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2)]. The final R and Rw were 0.037 and 0.046, respectively.
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13
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35649021409
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4 showed one broad signal in the T range measured.
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4 showed one broad signal in the T range measured.
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