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Information card for entry 7231300
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Coordinates | 7231300.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C44 H50 N2 O6 |
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Calculated formula | C44 H50 N2 O6 |
Title of publication | The thermo-responsive behavior in molecular crystals of naphthalene diimides and their 3D printed thermochromic composites |
Authors of publication | Dharmarwardana, Madushani; Arimilli, Bhargav S.; Luzuriaga, Michael A.; Kwon, Sunah; Lee, Hamilton; Appuhamillage, Gayan A.; McCandless, Gregory T.; Smaldone, Ronald A.; Gassensmith, Jeremiah J. |
Journal of publication | CrystEngComm |
Year of publication | 2018 |
Journal volume | 20 |
Journal issue | 39 |
Pages of publication | 6054 |
a | 4.154 ± 0.002 Å |
b | 51.72 ± 0.02 Å |
c | 8.253 ± 0.003 Å |
α | 90° |
β | 93.663 ± 0.012° |
γ | 90° |
Cell volume | 1769.5 ± 1.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 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 | 0.0933 |
Residual factor for significantly intense reflections | 0.0551 |
Weighted residual factors for significantly intense reflections | 0.1056 |
Weighted residual factors for all reflections included in the refinement | 0.1178 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
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/7231300.html
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