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Information card for entry 4030159
Preview
Coordinates | 4030159.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C25 H25 N O5 |
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Calculated formula | C25 H25 N O5 |
SMILES | C1(C)(C)OC(=O)C(C(=O)O1)=C/C(=C/C=C/N(Cc1ccccc1)Cc1ccccc1)O |
Title of publication | Design and synthesis of donor-acceptor Stenhouse adducts: a visible light photoswitch derived from furfural. |
Authors of publication | Helmy, Sameh; Oh, Saemi; Leibfarth, Frank A.; Hawker, Craig J.; Read de Alaniz, Javier |
Journal of publication | The Journal of organic chemistry |
Year of publication | 2014 |
Journal volume | 79 |
Journal issue | 23 |
Pages of publication | 11316 - 11329 |
a | 23.22 ± 0.007 Å |
b | 6.4634 ± 0.0018 Å |
c | 14.462 ± 0.004 Å |
α | 90° |
β | 94.873 ± 0.009° |
γ | 90° |
Cell volume | 2162.6 ± 1.1 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 9 |
Hermann-Mauguin space group symbol | C 1 c 1 |
Hall space group symbol | C -2yc |
Residual factor for all reflections | 0.0715 |
Residual factor for significantly intense reflections | 0.0634 |
Weighted residual factors for significantly intense reflections | 0.1398 |
Weighted residual factors for all reflections included in the refinement | 0.1429 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.722 |
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/4030159.html
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