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Information card for entry 7059461
Preview
Coordinates | 7059461.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C52 H98 N8 Ni6 O30 |
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Calculated formula | C52 H98 N8 Ni6 O30 |
Title of publication | A rod-like hexanuclear nickel cluster based on a bi(pyrazole-alcohol) ligand: structure, electrospray ionization mass spectrometry, magnetism and photocurrent response |
Authors of publication | Sheng, Kai; Ji, Bao-Qian; Feng, Lei; Su, Yan-Min; Jagodič, Marko; Jagličić, Zvonko; Sun, Di |
Journal of publication | New Journal of Chemistry |
Year of publication | 2020 |
Journal volume | 44 |
Journal issue | 17 |
Pages of publication | 7152 - 7157 |
a | 29.039 ± 0.003 Å |
b | 12.0094 ± 0.0011 Å |
c | 22.276 ± 0.002 Å |
α | 90° |
β | 111.48 ± 0.001° |
γ | 90° |
Cell volume | 7229 ± 1.2 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0722 |
Residual factor for significantly intense reflections | 0.0441 |
Weighted residual factors for significantly intense reflections | 0.0878 |
Weighted residual factors for all reflections included in the refinement | 0.0995 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.024 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7059461.html
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structural data.