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Information card for entry 7039806
Preview
Coordinates | 7039806.cif |
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Original paper (by DOI) | HTML |
Formula | C27 H31.8 N4 O15.4 P3 |
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Calculated formula | C27 H23.001 N4 O15.402 P3.001 |
Title of publication | Synthesis, solid-state characterization and solution studies of new phytate compounds with Cu(ii) and 1,10-phenanthroline: progress in the structural elucidation of phytate coordinating ability. |
Authors of publication | Quiñone, D; Veiga, N.; Torres, J.; Castiglioni, J.; Bazzicalupi, C.; Bianchi, A.; Kremer, C. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 30 |
Pages of publication | 12156 - 12166 |
a | 11.299 ± 0.001 Å |
b | 11.487 ± 0.001 Å |
c | 13.711 ± 0.002 Å |
α | 83.501 ± 0.009° |
β | 65.75 ± 0.01° |
γ | 73.38 ± 0.009° |
Cell volume | 1554.7 ± 0.3 Å3 |
Cell temperature | 120 K |
Ambient diffraction temperature | 120 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 | 0.1415 |
Residual factor for significantly intense reflections | 0.0758 |
Weighted residual factors for significantly intense reflections | 0.1719 |
Weighted residual factors for all reflections included in the refinement | 0.2063 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.073 |
Diffraction radiation wavelength | 1.5418 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/7039806.html
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