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Information card for entry 4069083
Preview
Coordinates | 4069083.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C61 H50 Ag Cl6 F6 N4 P |
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Calculated formula | C61 H50 Ag Cl6 F6 N4 P |
SMILES | [Ag](=C1N(c2c(N1c1ccc(cc1)C)c1ccccc1c1ccccc21)c1ccc(cc1)C)=C1N(c2c(N1c1ccc(cc1)C)c1ccccc1c1ccccc21)c1ccc(cc1)C.[P](F)(F)(F)(F)(F)[F-].C(Cl)Cl.C(Cl)Cl.C(Cl)Cl |
Title of publication | Annulated N-Heterocyclic Carbenes: 1,3-Ditolylphenanthreno[9,10-d]imidazol-2-ylidene and Transition Metal Complexes Thereof |
Authors of publication | Ullah, Farman; Kindermann, Markus K.; Jones, Peter G.; Heinicke, Joachim |
Journal of publication | Organometallics |
Year of publication | 2009 |
Journal volume | 28 |
Journal issue | 8 |
Pages of publication | 2441 |
a | 13.0015 ± 0.0004 Å |
b | 19.2789 ± 0.0008 Å |
c | 22.438 ± 0.0011 Å |
α | 90° |
β | 90.098 ± 0.003° |
γ | 90° |
Cell volume | 5624.2 ± 0.4 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 7 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0627 |
Residual factor for significantly intense reflections | 0.0435 |
Weighted residual factors for significantly intense reflections | 0.1079 |
Weighted residual factors for all reflections included in the refinement | 0.1219 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.05 |
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/4069083.html
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Users of the data should acknowledge the original authors of the
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