Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 2310150
Preview
| Coordinates | 2310150.cif |
|---|---|
| Structure factors | 2310150.hkl |
| Original paper (by DOI) | HTML |
| Formula | C55.61 H47.39 Cl2.1 I6 N12 Zn3 |
|---|---|
| Calculated formula | C55.615 H47.398 Cl2.1 I6 N12 Zn3 |
| Title of publication | Analysis of rapidly synthesized guest-filled porous complexes with synchrotron radiation: practical guidelines for the crystalline sponge method |
| Authors of publication | Ramadhar, Timothy R.; Zheng, Shao-Liang; Chen, Yu-Sheng; Clardy, Jon |
| Journal of publication | Acta Crystallographica Section A |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 1 |
| a | 34.936 ± 0.003 Å |
| b | 14.9785 ± 0.0013 Å |
| c | 30.825 ± 0.003 Å |
| α | 90° |
| β | 102.857 ± 0.0017° |
| γ | 90° |
| Cell volume | 15726 ± 2 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0914 |
| Residual factor for significantly intense reflections | 0.0852 |
| Weighted residual factors for significantly intense reflections | 0.2321 |
| Weighted residual factors for all reflections included in the refinement | 0.2392 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.08 |
| Diffraction radiation wavelength | 0.41321 Å |
| Diffraction radiation type | synchrotron |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181921 (current) | 2016-04-06 | hkl/2/31/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/31/01 |
2310150.cif 2310150.hkl |
| 181327 | 2016-04-03 | hkl/2/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/31. |
2310150.cif 2310150.hkl |
| 176435 | 2016-02-14 | cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2. |
2310150.cif 2310150.hkl |
| 127316 | 2014-11-15 | cif/ hkl/ Adding structures of 2310149, 2310150, 2310151, 2310152 via cif-deposit CGI script. |
2310150.cif 2310150.hkl |
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.