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Information card for entry 4313594
Preview
Coordinates | 4313594.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C86 H99 B2 Cl4 F8 N5 O4 Rh2 |
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Calculated formula | C86 H99 B2 Cl4 F8 N5 O4 Rh2 |
SMILES | [Rh]1234([CH]5=[CH]1C1[CH]3=[CH]2C5C1)[n]1ccc(cc1c1[n]4ccc(c1)C)COc1c2Cc3cc(cc(Cc4c(OCc5cc6[n]([Rh]789([CH]%10=[CH]7C7[CH]9=[CH]8C%10C7)[n]7ccc(cc67)C)cc5)c(Cc5c(O)c(cc(c5)C(C)(C)C)Cc1cc(c2)C(C)(C)C)cc(c4)C(C)(C)C)c3O)C(C)(C)C.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-].ClCCl.ClCCl.C(#N)C |
Title of publication | A New Ligand System Based on a Bipyridine-Functionalized Calix[4]arene Backbone Leading to Mono- and Bimetallic Complexes |
Authors of publication | Reto Dorta; Linda J. W. Shimon; Haim Rozenberg; Yehoshoa Ben-David; David Milstein |
Journal of publication | Inorganic Chemistry |
Year of publication | 2003 |
Journal volume | 42 |
Pages of publication | 3160 - 3167 |
a | 15.191 ± 0.003 Å |
b | 23.208 ± 0.005 Å |
c | 47.149 ± 0.009 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 16623 ± 6 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 8 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.0873 |
Residual factor for significantly intense reflections | 0.0743 |
Weighted residual factors for significantly intense reflections | 0.1975 |
Weighted residual factors for all reflections included in the refinement | 0.2089 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
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/4313594.html
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