Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7702369
Preview
Coordinates | 7702369.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Copper-selenide-nanocluster |
---|---|
Chemical name | The CIF file for the structure of Nr. 6 |
Formula | C216 H540 Cu140 P36 Se70 |
Calculated formula | C137 Cu140.02 P36 Se70 |
Title of publication | Novel Cu‒Se clusters with Se‒layer structures: [Cu32Se7(SenBu)18(PiPr3)6], [Cu50Se20(SetBu)10(PiPr3)10], [Cu73Se35(SePh)3(PiPr3)21], [Cu140Se70(PEt3)34] and [Cu140Se70(PEt3)36] |
Authors of publication | Zhu, Nianyong; Fenske, Dieter |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 1999 |
Journal issue | 7 |
Pages of publication | 1067 |
a | 31.65 ± 0.006 Å |
b | 22.55 ± 0.005 Å |
c | 37.84 ± 0.008 Å |
α | 90° |
β | 97.92 ± 0.03° |
γ | 90° |
Cell volume | 26749 ± 10 Å3 |
Cell temperature | 203 ± 2 K |
Ambient diffraction temperature | 203 ± 2 K |
Number of distinct elements | 5 |
Space group number | 11 |
Hermann-Mauguin space group symbol | P 1 21/m 1 |
Hall space group symbol | -P 2yb |
Residual factor for all reflections | 0.2611 |
Residual factor for significantly intense reflections | 0.0867 |
Weighted residual factors for all reflections | 0.3236 |
Weighted residual factors for significantly intense reflections | 0.2196 |
Goodness-of-fit parameter for all reflections | 1.092 |
Goodness-of-fit parameter for significantly intense reflections | 1.44 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKa |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7702369.html
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.