Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4107144
Preview
Coordinates | 4107144.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C61 H86 Cu Ge3 I P6 Pd4 |
---|---|
Calculated formula | C61 H86 Cu Ge3 I P6 Pd4 |
SMILES | I[Cu]1[Pd]23456[Pd]781([Ge]5([Pd]13([Ge]4([Pd]32([Ge]67(c2ccccc2)c2ccccc2)[P](C)(C)CC[P]3(C)C)(c2ccccc2)c2ccccc2)[P](C)(C)CC[P]1(C)C)(c1ccccc1)c1ccccc1)[P](C)(C)CC[P]8(C)C.Cc1ccccc1 |
Title of publication | Tetrapalladium Complex with Bridging Germylene Ligands. Structural Change of the Planar Pd4Ge3 Core |
Authors of publication | Makoto Tanabe; Naoko Ishikawa; Mai Chiba; Tomohito Ide; Kohtaro Osakada; Tomoaki Tanase |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2011 |
Journal volume | 133 |
Pages of publication | 18598 - 18601 |
a | 14.3194 ± 0.0018 Å |
b | 29.746 ± 0.006 Å |
c | 16.545 ± 0.004 Å |
α | 90° |
β | 91.426 ± 0.007° |
γ | 90° |
Cell volume | 7045 ± 2 Å3 |
Cell temperature | 113.1 K |
Ambient diffraction temperature | 113.1 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.109 |
Residual factor for significantly intense reflections | 0.0787 |
Weighted residual factors for significantly intense reflections | 0.1844 |
Weighted residual factors for all reflections included in the refinement | 0.2065 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.051 |
Diffraction radiation wavelength | 0.7107 Å |
Diffraction radiation type | MoKα |
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/4107144.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.