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Information card for 7015636

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Coordinates

7015636.cif

Structure parameters

Formula - C20 H29 Cl N6 O3 Ru -
Calculated formula - C20 H29 Cl N6 O3 Ru -
Title of publication Synthesis, characterization, crystal structure and preliminary reactivity behaviour of new heteropolytopic ligands based on the 1,3,5-triazine spacer and pyrazolyl, tris-pyrazolylmethyl and tris-pyrazolylethoxy bonding fragments.
Authors of publication Di Nicola, C.; Garau, F.; Marchetti, F.; Monari, M.; Pandolfo, L.; Pettinari, C.; Venzo, A.
Journal of publication Dalton transactions (Cambridge, England : 2003)
Year of publication 2011
Journal volume 40
Journal issue 18
Pages of publication 4941 - 4953
a 10.8075 ± 0.001 Å
b 11.1046 ± 0.0011 Å
c 12.2293 ± 0.0015 Å
α 64.71 ± 0.001°
β 87.819 ± 0.001°
γ 62.456 ± 0.001°
Cell volume 1153.1 ± 0.2 Å3
Cell temperature 293 ± 2 K
Ambient diffraction temperature 293 ± 2 K
Number of distinct elements 6
Hermann-Mauguin symmetry space group P -1
Hall symmetry space group -P 1
Residual factor for all reflections 0.0435
Residual factor for observed reflections 0.0398
Weighted residual factors for the observed reflections 0.1273
Weighted residual factors for all reflections included in the refinement 0.1298
Goodness-of-fit parameter for observed reflections 1.14
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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