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Information card for 7015534

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Coordinates

7015534.cif

Structure parameters

Formula - C7 H7 Cl2 Cu N7 -
Calculated formula - C7 H7 Cl2 Cu N7 -
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 15.1972 ± 0.0007 Å
b 12.5443 ± 0.0006 Å
c 14.1168 ± 0.001 Å
α 90°
β 119.04°
γ 90°
Cell volume 2352.9 ± 0.2 Å3
Cell temperature 173 ± 2 K
Ambient diffraction temperature 173 ± 2 K
Number of distinct elements 5
Hermann-Mauguin symmetry space group C 1 2/c 1
Hall symmetry space group -C 2yc
Residual factor for all reflections 0.0235
Residual factor for observed reflections 0.0209
Weighted residual factors for the observed reflections 0.0537
Weighted residual factors for all reflections included in the refinement 0.0553
Goodness-of-fit parameter for observed reflections 0.974
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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