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Information card for entry 7128990
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 7128990.cif |
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Original paper (by DOI) | HTML |
Formula | C15 H15 N3 Ni O4 S |
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Calculated formula | C15 H15 N3 Ni O4 S |
Title of publication | Intramolecular H-bond stabilization of a primary hydroxylamine in salen-type metal complexes. |
Authors of publication | Singh, Hardeep; MacKay, Alyson; Sheibany, Nooshin; Chen, Fei; Mosser, Maëlle; Rouet, Pierre-Étienne; Rousseau, Frédéric; Askari, Mohammad S.; Ottenwaelder, Xavier |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2021 |
Journal volume | 57 |
Journal issue | 80 |
Pages of publication | 10403 - 10406 |
a | 14.9422 ± 0.0017 Å |
b | 14.9487 ± 0.0017 Å |
c | 13.7186 ± 0.0016 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3064.3 ± 0.6 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 60 |
Hermann-Mauguin space group symbol | P b c n |
Hall space group symbol | -P 2n 2ab |
Residual factor for all reflections | 0.0323 |
Residual factor for significantly intense reflections | 0.0278 |
Weighted residual factors for significantly intense reflections | 0.0651 |
Weighted residual factors for all reflections included in the refinement | 0.0665 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/7128990.html
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