Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1551402
Preview
Coordinates | 1551402.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C448 H415 B7 F6 Fe6 N40 O15 P |
---|---|
Calculated formula | C508.94 H401 B7.67 F6 Fe6 N40 O15 P |
Title of publication | A Star of David catenane |
Authors of publication | David A. Leigh; Robin G. Pritchard; Alexander J. Stephens |
Journal of publication | Nature Chemistry |
Year of publication | 2013 |
Journal volume | 6 |
Pages of publication | 978 - 982 |
a | 35.1918 ± 0.0018 Å |
b | 47.1545 ± 0.0018 Å |
c | 33.4757 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 55551 ± 4 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 8 |
Space group number | 55 |
Hermann-Mauguin space group symbol | P b a m |
Hall space group symbol | -P 2 2ab |
Residual factor for all reflections | 0.2373 |
Residual factor for significantly intense reflections | 0.1727 |
Weighted residual factors for significantly intense reflections | 0.3425 |
Weighted residual factors for all reflections included in the refinement | 0.3685 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.586 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 0.6889 Å |
Diffraction radiation type | synchrotron |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
215932 (current) | 2019-06-13 | cif/ Adding structures of 1551402 via cif-deposit CGI script. |
1551402.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.