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Information card for entry 7044227
Preview
Coordinates | 7044227.cif |
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Original paper (by DOI) | HTML |
Formula | C22 H39 Co2 N16 O2 |
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Calculated formula | C22 H39 Co2 N16 O2 |
SMILES | c12c3cc(cc1C=[N]1CC[N](CC)(CC)[Co]41(N=N#N)(N=N#N)[N]([Co]1([N](=C3)CC[N]1(CC)CC)(N=N#N)[O]24)=N#N)C.CO |
Title of publication | Syntheses, crystal structures and magnetic properties of two mixed-valence Co(III)Co(II) compounds derived from Schiff base ligands: Field supported single-ion-magnet behaviour with easy plane anisotropy |
Authors of publication | Mandal, Shuvankar; Mondal, Suraj; Rajnak, Cyril; Titis, Jan; Boca, Roman; Mohanta, Sasankasekhar |
Journal of publication | Dalton Trans. |
Year of publication | 2017 |
a | 8.424 ± 0.006 Å |
b | 13.764 ± 0.009 Å |
c | 25.759 ± 0.016 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 2987 ± 3 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 5 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.1673 |
Residual factor for significantly intense reflections | 0.0797 |
Weighted residual factors for significantly intense reflections | 0.1745 |
Weighted residual factors for all reflections included in the refinement | 0.2173 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.004 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
200876 (current) | 2017-09-14 | cif/ Adding structures of 7044226, 7044227 via cif-deposit CGI script. |
7044227.cif |
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