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Information card for 7015572

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Coordinates

7015572.cif

Structure parameters

Formula - C22 H21 Cu F9 N4 O7 S2 -
Calculated formula - C22 H21 Cu F9 N4 O7 S2 -
Title of publication When is an imine not an imine? Unusual reactivity of a series of Cu(II) imine-pyridine complexes and their exploitation for the Henry reaction.
Authors of publication Cooper, Christine J.; Jones, Matthew D.; Brayshaw, Simon K.; Sonnex, Benjamin; Russell, Mark L.; Mahon, Mary F.; Allan, David R.
Journal of publication Dalton transactions (Cambridge, England : 2003)
Year of publication 2011
Journal volume 40
Journal issue 14
Pages of publication 3677 - 3682
a 9.545 ± 0.0008 Å
b 11.426 ± 0.001 Å
c 13.698 ± 0.0012 Å
α 78.636 ± 0.006°
β 83.184 ± 0.005°
γ 88.992 ± 0.005°
Cell volume 1454.3 ± 0.2 Å3
Cell temperature 150 ± 2 K
Ambient diffraction temperature 150 ± 2 K
Number of distinct elements 7
Hermann-Mauguin symmetry space group P 1
Hall symmetry space group P 1
Residual factor for all reflections 0.0869
Residual factor for observed reflections 0.0548
Weighted residual factors for the observed reflections 0.1137
Weighted residual factors for all reflections included in the refinement 0.1313
Goodness-of-fit parameter for observed reflections 1.048
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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