Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7132840
Preview
Coordinates | 7132840.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C47 H20.5 Cl0.5 F16 N3 P Pd S |
---|---|
Calculated formula | C47 H20.5 Cl0.5 F16 N3 P Pd S |
Title of publication | Substitution-pattern- and counteranion-dependent ion-pairing assemblies of heteroporphyrin-based π-electronic cations. |
Authors of publication | Fujita, Masaki; Haketa, Yohei; Seki, Shu; Maeda, Hiromitsu |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2024 |
Journal volume | 60 |
Journal issue | 31 |
Pages of publication | 4190 - 4193 |
a | 28.14 ± 0.011 Å |
b | 14.513 ± 0.009 Å |
c | 20.554 ± 0.01 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 8394 ± 7 Å3 |
Cell temperature | 90 ± 2 K |
Ambient diffraction temperature | 90 ± 2 K |
Number of distinct elements | 8 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P n a 21 |
Hall space group symbol | P 2c -2n |
Residual factor for all reflections | 0.0394 |
Residual factor for significantly intense reflections | 0.0364 |
Weighted residual factors for significantly intense reflections | 0.0914 |
Weighted residual factors for all reflections included in the refinement | 0.093 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
Diffraction radiation wavelength | 0.4136 Å |
Diffraction radiation type | Synchrotron |
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/7132840.html
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.