Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4001622
Preview
Coordinates | 4001622.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C37 H29 Cl7 Cu N P2 |
---|---|
Calculated formula | C37 H29 Cl7 Cu N P2 |
Title of publication | Three-Dimensional Phosphine Metal‒Organic Frameworks Assembled from Cu(I) and Pyridyl Diphosphine |
Authors of publication | Tan, Xin; Li, Lei; Zhang, Jianyong; Han, Xiaorui; Jiang, Long; Li, Fuwei; Su, Cheng-Yong |
Journal of publication | Chemistry of Materials |
Year of publication | 2012 |
Journal volume | 24 |
Journal issue | 3 |
Pages of publication | 480 |
a | 18.41 ± 0.004 Å |
b | 18.41 ± 0.004 Å |
c | 21.321 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 120° |
Cell volume | 6258 ± 2 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 6 |
Space group number | 154 |
Hermann-Mauguin space group symbol | P 32 2 1 |
Hall space group symbol | P 32 2" |
Residual factor for all reflections | 0.2134 |
Residual factor for significantly intense reflections | 0.1237 |
Weighted residual factors for significantly intense reflections | 0.2375 |
Weighted residual factors for all reflections included in the refinement | 0.2615 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.118 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
178377 (current) | 2016-03-21 | cif/4/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/00. |
4001622.cif |
91935 | 2013-12-29 | cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs. |
4001622.cif |
51850 | 2012-04-07 | ../uploads/cif-deposit/cod/cif Adding structures of 4001621, 4001622 via cif-deposit CGI script. |
4001622.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.