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Information card for entry 8105171
Preview
Coordinates | 8105171.cif |
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Original paper (by DOI) | HTML |
Formula | C44 H34 N2 O4 |
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Calculated formula | C44 H34 N2 O4 |
Title of publication | Crystal structure of 1,3,5,7-tetraphenyl-8-(N-phenylformamido)-2-oxa-5-azabicyclo[4.2.0]oct -3-en-7-yl benzoate, C44H34N2O4 |
Authors of publication | Li, Xue; Zhang, Meng-Meng; Chong, Ying-Zhi; Cui, Li-Hua; Ma, Yu; Feng, Fu-Min |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2020 |
Journal volume | 235 |
Journal issue | 3 |
Pages of publication | 557 - 559 |
a | 10.4564 ± 0.0013 Å |
b | 11.3627 ± 0.0014 Å |
c | 15.3946 ± 0.0019 Å |
α | 82.106 ± 0.002° |
β | 75.318 ± 0.002° |
γ | 77.704 ± 0.002° |
Cell volume | 1722 ± 0.4 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296.15 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0684 |
Residual factor for significantly intense reflections | 0.042 |
Weighted residual factors for significantly intense reflections | 0.0935 |
Weighted residual factors for all reflections included in the refinement | 0.1086 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.015 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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