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Information card for entry 7060109
Preview
Coordinates | 7060109.cif |
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Original paper (by DOI) | HTML |
Formula | C16 H13 Cl Fe N2 O |
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Calculated formula | C16 H13 Cl Fe N2 O |
Title of publication | Regorafenib analogues and their ferrocenic counterparts: synthesis and biological evaluation |
Authors of publication | Wilde, Myron; Arzur, Danielle; Baratte, Blandine; Lefebvre, Dorian; Robert, Thomas; Roisnel, Thierry; Le Jossic-Corcos, Catherine; Bach, Stéphane; Corcos, Laurent; Erb, William |
Journal of publication | New Journal of Chemistry |
Year of publication | 2020 |
Journal volume | 44 |
Journal issue | 45 |
Pages of publication | 19723 - 19733 |
a | 13.2083 ± 0.0011 Å |
b | 9.7083 ± 0.0008 Å |
c | 10.6102 ± 0.0007 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1360.55 ± 0.18 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 6 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P n a 21 |
Hall space group symbol | P 2c -2n |
Residual factor for all reflections | 0.0251 |
Residual factor for significantly intense reflections | 0.0236 |
Weighted residual factors for significantly intense reflections | 0.0633 |
Weighted residual factors for all reflections included in the refinement | 0.0649 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.904 |
Diffraction radiation probe | x-ray |
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/7060109.html
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