Information card for entry 7209058
| Formula |
C8 H12 N Ni0.5 O7.5 P2 |
| Calculated formula |
C8 H12 N Ni0.5 O7.5 P2 |
| Title of publication |
Synthesis, crystal structures, and surface photovoltage properties of four new metal diphosphonates based on the mixed ligands |
| Authors of publication |
Zheng, Ming-Jing; Zhu, Yan-Yu; Sun, Zhen-Gang; Zhu, Jiang; Jiao, Cheng-Qi; Chu, Wei; Sun, Shou-Hui; Tian, Hui |
| Journal of publication |
CrystEngComm |
| Year of publication |
2013 |
| Journal volume |
15 |
| Journal issue |
7 |
| Pages of publication |
1445 |
| a |
17.096 ± 0.0008 Å |
| b |
18.5599 ± 0.0008 Å |
| c |
7.5289 ± 0.0004 Å |
| α |
90° |
| β |
90.223 ± 0.001° |
| γ |
90° |
| Cell volume |
2388.9 ± 0.2 Å3 |
| Cell temperature |
295 ± 2 K |
| Ambient diffraction temperature |
295 ± 2 K |
| Number of distinct elements |
6 |
| 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 |
0.0592 |
| Residual factor for significantly intense reflections |
0.0482 |
| Weighted residual factors for significantly intense reflections |
0.1956 |
| Weighted residual factors for all reflections included in the refinement |
0.2264 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.022 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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