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Information card for entry 4511920
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Coordinates | 4511920.cif |
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Original paper (by DOI) | HTML |
Common name | RsC1, bpe, acetonitrile |
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Chemical name | C-methylresorcinol[4]arene, trans-1,2-Bis(4-pyridyl)ethylene, acetonitrile |
Formula | C64 H64 N8 O8 |
Calculated formula | C64 H52 N8 O8 |
Title of publication | Engineering Void Space Enclosed within Resorcin[4]arene-Based Supramolecular Frameworks |
Authors of publication | Patil, Rahul S.; Mossine, Andrew V.; Kumari, Harshita; Barnes, Charles L.; Atwood, Jerry L. |
Journal of publication | Crystal Growth & Design |
Year of publication | 2014 |
Journal volume | 14 |
Journal issue | 10 |
Pages of publication | 5212 |
a | 10.051 ± 0.002 Å |
b | 25.409 ± 0.005 Å |
c | 11.661 ± 0.002 Å |
α | 90° |
β | 91.889 ± 0.002° |
γ | 90° |
Cell volume | 2976.4 ± 1 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 4 |
Space group number | 11 |
Hermann-Mauguin space group symbol | P 1 21/m 1 |
Hall space group symbol | -P 2yb |
Residual factor for all reflections | 0.117 |
Residual factor for significantly intense reflections | 0.0846 |
Weighted residual factors for significantly intense reflections | 0.2357 |
Weighted residual factors for all reflections included in the refinement | 0.2535 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.138 |
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/4511920.html
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