Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 4076508
Preview

Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 4076508.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H26 Si |
---|---|
Calculated formula | C34 H26 Si |
SMILES | [Si](C(=C\c1ccccc1)\C#Cc1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Selective Hydrosilylation of 1,3-Diynes Catalyzed by Titania-Supported Platinum |
Authors of publication | Alonso, Francisco; Buitrago, Robison; Moglie, Yanina; Sepúlveda-Escribano, Antonio; Yus, Miguel |
Journal of publication | Organometallics |
Year of publication | 2012 |
Journal volume | 31 |
Journal issue | 6 |
Pages of publication | 2336 |
a | 7.5995 ± 0.0011 Å |
b | 9.4638 ± 0.0014 Å |
c | 20.008 ± 0.003 Å |
α | 92.218 ± 0.003° |
β | 93.955 ± 0.003° |
γ | 113.068 ± 0.003° |
Cell volume | 1317.4 ± 0.3 Å3 |
Cell temperature | 298 ± 1 K |
Ambient diffraction temperature | 298 ± 1 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0843 |
Residual factor for significantly intense reflections | 0.0488 |
Weighted residual factors for significantly intense reflections | 0.112 |
Weighted residual factors for all reflections included in the refinement | 0.127 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.014 |
Diffraction radiation wavelength | 0.71073 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/4076508.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.