Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1564646
Preview
Coordinates | 1564646.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C32 H20 Al F36 Fe O4 P5 Se |
---|---|
Calculated formula | C32 H20 Al F36 Fe O4 P5 Se |
Title of publication | Substituted aromatic pentaphosphole ligands ‒ a journey across the p-block |
Authors of publication | Riesinger, Christoph; Balázs, Gábor; Seidl, Michael; Scheer, Manfred |
Journal of publication | Chemical Science |
Year of publication | 2021 |
a | 12.1286 ± 0.0004 Å |
b | 12.6674 ± 0.0005 Å |
c | 17.2846 ± 0.0008 Å |
α | 107.67 ± 0.004° |
β | 96.922 ± 0.003° |
γ | 90.247 ± 0.003° |
Cell volume | 2509.49 ± 0.18 Å3 |
Cell temperature | 123 ± 1 K |
Ambient diffraction temperature | 123 ± 1 K |
Number of distinct elements | 8 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0743 |
Residual factor for significantly intense reflections | 0.0508 |
Weighted residual factors for significantly intense reflections | 0.1169 |
Weighted residual factors for all reflections included in the refinement | 0.1329 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.059 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
269134 (current) | 2021-09-15 | cif/ Adding structures of 1564638, 1564639, 1564640, 1564641, 1564642, 1564643, 1564644, 1564645, 1564646, 1564647, 1564648 via cif-deposit CGI script. |
1564646.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.