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Information card for entry 8106508
Preview
Coordinates | 8106508.cif |
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Original paper (by DOI) | HTML |
Formula | C24 H21 N3 O5 |
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Calculated formula | C24 H21 N3 O5 |
Title of publication | Crystal structure of methyl 3-((1-(2-(methoxycarbonyl)benzyl)-1H-1,2,3-triazol-4-yl)methoxy)-2-naphthoate, C24H21N3O5 |
Authors of publication | Tan, Xiaoli; Hong, Wei; Wang, Meiyi; Wang, Hao |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2017 |
Journal volume | 232 |
Journal issue | 2 |
Pages of publication | 273 - 274 |
a | 5.8731 ± 0.0006 Å |
b | 12.4675 ± 0.001 Å |
c | 28.912 ± 0.003 Å |
α | 90° |
β | 90.271 ± 0.007° |
γ | 90° |
Cell volume | 2117 ± 0.4 Å3 |
Cell temperature | 293.23 ± 0.1 K |
Ambient diffraction temperature | 293.23 ± 0.1 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.197 |
Residual factor for significantly intense reflections | 0.0797 |
Weighted residual factors for significantly intense reflections | 0.1224 |
Weighted residual factors for all reflections included in the refinement | 0.1733 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.044 |
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/8106508.html
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