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Information card for entry 2232334
Preview
Coordinates | 2232334.cif |
---|---|
Structure factors | 2232334.hkl |
Original IUCr paper | HTML |
Common name | Trirubidium‒tris-18-crown-6-heptaantimonide‒ammonia (1/4) |
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Chemical name | Tris[(1,4,7,10,13,16-hexaoxacyclooctadecane)rubidium] heptaantimonide‒ ammonia (1/4) |
Formula | C36 H84 N4 O18 Rb3 Sb7 |
Calculated formula | C36 H84 N4 O18 Rb3 Sb7 |
SMILES | [Sb]1[Sb]2[Sb][Sb]3[Sb]([Sb]2)[Sb]13.[Rb]12345[O]6CC[O]5CC[O]3CC[O]4CC[O]2CC[O]1CC6.[Rb]12345[O]6CC[O]3CC[O]5CC[O]2CC[O]1CC[O]4CC6.[Rb]12345[O]6CC[O]3CC[O]5CC[O]1CC[O]2CC[O]4CC6.N.N.N.N |
Title of publication | Tris[(1,4,7,10,13,16-hexaoxacyclooctadecane)rubidium] heptaantimonide‒ammonia (1/4) |
Authors of publication | Mutzbauer, Fabian; Korber, Nikolaus |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2011 |
Journal volume | 67 |
Journal issue | 11 |
Pages of publication | m1551 |
a | 15 ± 0.003 Å |
b | 17.484 ± 0.004 Å |
c | 25.158 ± 0.005 Å |
α | 90° |
β | 90.98 ± 0.03° |
γ | 90° |
Cell volume | 6597 ± 2 Å3 |
Cell temperature | 123 ± 2 K |
Ambient diffraction temperature | 123 ± 2 K |
Number of distinct elements | 6 |
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 | 0.054 |
Residual factor for significantly intense reflections | 0.0361 |
Weighted residual factors for significantly intense reflections | 0.0779 |
Weighted residual factors for all reflections included in the refinement | 0.0825 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.962 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2232334.html
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Users of the data should acknowledge the original authors of the
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