Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7026651
Preview
Coordinates | 7026651.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C21 H33 Fe N Na2 O2 P2 |
---|---|
Calculated formula | C21 H33 Fe N Na2 O2 P2 |
SMILES | [Na+].[PH-][c]12[cH]3[cH]4[cH]5[cH]1[Fe]16782345[cH]2[cH]1[cH]7[c]8([PH-])[c]26CN(C)C.[Na+].O1CCCC1.O1CCCC1 |
Title of publication | A sodium ferrocenyl-phosphanide polymer based on racemic primary aminoalkyl(bisphosphanyl)ferrocene. |
Authors of publication | Limburg, Carolin; Gómez-Ruiz, Santiago; Hey-Hawkins, Evamarie |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2010 |
Journal volume | 39 |
Journal issue | 31 |
Pages of publication | 7217 - 7219 |
a | 10.3812 ± 0.0004 Å |
b | 10.9169 ± 0.0003 Å |
c | 12.2737 ± 0.0004 Å |
α | 74.681 ± 0.003° |
β | 69.882 ± 0.003° |
γ | 70.925 ± 0.003° |
Cell volume | 1216.21 ± 0.08 Å3 |
Cell temperature | 130 ± 2 K |
Ambient diffraction temperature | 130 ± 2 K |
Number of distinct elements | 7 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0867 |
Residual factor for significantly intense reflections | 0.0507 |
Weighted residual factors for significantly intense reflections | 0.1209 |
Weighted residual factors for all reflections included in the refinement | 0.1308 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.001 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7026651.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.