Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7045405
Preview
Coordinates | 7045405.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C82 H92 Cl14 N8 O14 Zn4 |
---|---|
Calculated formula | C82 H92 Cl14 N8 O14 Zn4 |
Title of publication | Studies towards the synthesis of Pd(ii)-containing [2] and [3]catenanes in aqueous media. |
Authors of publication | López-Vidal, E M; Prokofjevs, A.; Gibbs-Hall, I C; Dale, E. J.; Quintela, J. M.; Peinador, C. |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2018 |
Journal volume | 47 |
Journal issue | 8 |
Pages of publication | 2492 - 2496 |
a | 14.528 ± 0.001 Å |
b | 16.6911 ± 0.0012 Å |
c | 20.7097 ± 0.0014 Å |
α | 105.917 ± 0.003° |
β | 91.108 ± 0.003° |
γ | 105.758 ± 0.003° |
Cell volume | 4623.9 ± 0.6 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0737 |
Residual factor for significantly intense reflections | 0.0685 |
Weighted residual factors for significantly intense reflections | 0.1951 |
Weighted residual factors for all reflections included in the refinement | 0.2022 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
229411 (current) | 2019-11-17 | cif/ Updating files of 7045404, 7045405 Original log message: Adding full bibliography for 7045404--7045405.cif. |
7045405.cif |
205624 | 2018-01-25 | cif/ Adding structures of 7045404, 7045405 via cif-deposit CGI script. |
7045405.cif |
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.