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Information card for entry 1571712
Preview
Coordinates | 1571712.cif |
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Original paper (by DOI) | HTML |
Formula | C160 H168 N14 Ni3 |
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Calculated formula | C160 H168 N14 Ni3 |
Title of publication | Synthesis of NiII Porphyrin—NiII 5,15-Diazaporphyrin Hybrid Tapes |
Authors of publication | Song, Jianxin; Wang, Lina; Liao, Zian; Lin, Peng; Jia, Yingying; Liu, Le; Xu, Ling; Zhou, Mingbo; Yin, Bangshao; Rao, Yutao; Nakai, Akito; Tanaka, Takayuki; Shimizu, Daiki; Osuka, Atsuhiro |
Journal of publication | Chemical Science |
Year of publication | 2024 |
a | 16.4956 ± 0.0003 Å |
b | 19.5137 ± 0.0008 Å |
c | 27.9638 ± 0.0006 Å |
α | 90° |
β | 98.4471 ± 0.0018° |
γ | 90° |
Cell volume | 8903.6 ± 0.4 Å3 |
Cell temperature | 100.2 ± 0.5 K |
Ambient diffraction temperature | 100.2 ± 0.5 K |
Number of distinct elements | 4 |
Space group number | 13 |
Hermann-Mauguin space group symbol | P 1 2/n 1 |
Hall space group symbol | -P 2yac |
Residual factor for all reflections | 0.1191 |
Residual factor for significantly intense reflections | 0.0939 |
Weighted residual factors for significantly intense reflections | 0.285 |
Weighted residual factors for all reflections included in the refinement | 0.3089 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.126 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
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/1571712.html
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Users of the data should acknowledge the original authors of the
structural data.