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Information card for entry 2008270
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Coordinates | 2008270.cif |
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Original IUCr paper | HTML |
Formula | C15 H17 Gd N6 O12 |
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Calculated formula | C15 H17 Gd N6 O12 |
SMILES | c1[n]2c(ccc1)c1[n]3[Gd]452([OH2])(ON(=[O]5)=O)(ON(=[O]4)=O)([n]2c(c3ccc1)cccc2)([OH2])[OH2].N(=O)(=O)[O-] |
Title of publication | Triaquabis(nitrato-<i>O</i>,<i>O</i>')(2,2':6',2''-terpyridine-κ^3^<i>N</i>)gadolinium(III) nitrate |
Authors of publication | Leverd, Pascal C.; Charbonnel, Marie-Christine; Dognon, Jean-Pierre; Lance, Monique; Nierlich, Martine |
Journal of publication | Acta Crystallographica Section C |
Year of publication | 1999 |
Journal volume | 55 |
Journal issue | 3 |
Pages of publication | 368 - 370 |
a | 8.8005 ± 0.0003 Å |
b | 11.1 ± 0.0005 Å |
c | 11.628 ± 0.0005 Å |
α | 89.746 ± 0.002° |
β | 69.678 ± 0.003° |
γ | 75.414 ± 0.003° |
Cell volume | 1026.53 ± 0.08 Å3 |
Cell temperature | 123 ± 2 K |
Ambient diffraction temperature | 123 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.033 |
Residual factor for significantly intense reflections | 0.027 |
Weighted residual factors for all reflections | 0.07 |
Weighted residual factors for significantly intense reflections | 0.062 |
Goodness-of-fit parameter for all reflections | 0.963 |
Goodness-of-fit parameter for significantly intense reflections | 0.972 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/2008270.html
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