Information card for entry 4003956
Formula |
C42 H26 |
Calculated formula |
C184 H104 |
Title of publication |
B2N2-Doped Dibenzo[a,m]Rubicene: Modular Synthesis, Properties, and Coordination-Induced Color Tunability |
Authors of publication |
Sakamaki, Takumi; Nakamuro, Takayuki; Yamashita, Keitaro; Hirata, Kunio; Shang, Rui; Nakamura, Eiichi |
Journal of publication |
Chemistry of Materials |
Year of publication |
2021 |
a |
20.69 Å |
b |
6.2 Å |
c |
22 Å |
α |
90° |
β |
92.09° |
γ |
90° |
Cell volume |
2820.24 Å3 |
Cell temperature |
293 ± 2 K |
Ambient diffraction temperature |
293 ± 2 K |
Number of distinct elements |
2 |
Space group number |
15 |
Hermann-Mauguin space group symbol |
C 1 2/c 1 |
Hall space group symbol |
-C 2yc |
Residual factor for all reflections |
0.0574 |
Residual factor for significantly intense reflections |
0.0552 |
Weighted residual factors for significantly intense reflections |
0.1409 |
Weighted residual factors for all reflections included in the refinement |
0.1429 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.059 |
Diffraction radiation wavelength |
0.7 Å |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
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https://www.crystallography.net/4003956.html