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23
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85088892464
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Crystal data: C10H11N3, colourless, M, 173.22, T, 120 (2)K, monoclinic, space group c2, a, 25.9750(3, b =9.5820(6, c, 7.8299(7)Å, β, 107.541(3)°, V =1858.2(2) Å3, Z, 8, Dx, 1.238 gcm-3, monochromated Mo-Kα radiation, λ, 0.71073 Å, μ, 0.078 mm-1
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-1.
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24
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85036972842
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Data collection. The unit cell and intensity data were collected on a Bruker-Nonius diffractometer. 5454 reflections were collected, of which 2925 [R(int) = 0.0489]were independent reflections, with the 2θ range for data collection of 2.28 to 24.99°.
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Data collection. The unit cell and intensity data were collected on a Bruker-Nonius diffractometer. 5454 reflections were collected, of which 2925 [R(int) = 0.0489]were independent reflections, with the 2θ range for data collection of 2.28 to 24.99°.
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25
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85036989798
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Structure Solution and Refinement: Structure solution and refinement were achieved using SHELX97 and SHELXL97. Full matrix least squares on F2 of data converged to R1=0.0437, wR2=0.0841 [I>2σI]. Atomic coordinates, bond lengths, angles and thermal parameters have been deposited at the Cambridge Crystallographic Data Center, deposition number CCDC 635098.
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Structure Solution and Refinement: Structure solution and refinement were achieved using SHELX97 and SHELXL97. Full matrix least squares on F2 of data converged to R1=0.0437, wR2=0.0841 [I>2σI]. Atomic coordinates, bond lengths, angles and thermal parameters have been deposited at the Cambridge Crystallographic Data Center, deposition number CCDC 635098.
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