Crystallography Open Database





Information card for 7015535

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Coordinates

7015535.cif

Structure parameters

Formula - C7 H9 Cu N9 O7 -
Calculated formula - C7 H9 Cu N9 O7 -
Title of publication Tridentate complexes of 2,6-bis(4-substituted-1,2,3-triazol-1-ylmethyl)pyridine and its organic azide precursors: an application of the copper(II) acetate-accelerated azide-alkyne cycloaddition.
Authors of publication Brotherton, Wendy S.; Guha, Pampa M.; Phan, Hoa; Clark, Ronald J.; Shatruk, Michael; Zhu, Lei
Journal of publication Dalton transactions (Cambridge, England : 2003)
Year of publication 2011
Journal volume 40
Journal issue 14
Pages of publication 3655 - 3665
a 15.5617 ± 0.0012 Å
b 11.3047 ± 0.0009 Å
c 7.9984 ± 0.0006 Å
α 90°
β 90°
γ 90°
Cell volume 1407.08 ± 0.19 Å3
Cell temperature 173 ± 2 K
Ambient diffraction temperature 173 ± 2 K
Number of distinct elements 5
Hermann-Mauguin symmetry space group P b c n
Hall symmetry space group -P 2n 2ab
Residual factor for all reflections 0.0266
Residual factor for observed reflections 0.0233
Weighted residual factors for the observed reflections 0.0631
Weighted residual factors for all reflections included in the refinement 0.0651
Goodness-of-fit parameter for observed reflections 1.065
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder Yes
Has Fobs No

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