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Information card for entry 7127006
Preview
Coordinates | 7127006.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C9 H8 N4 |
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Calculated formula | C9 H8 N4 |
Title of publication | Fourfold symmetric MCR's <i>via</i> the tetraisocyanide 1,3-diisocyano-2,2-bis(isocyanomethyl)propane. |
Authors of publication | Butera, Roberto; Shrinidhi, Annadka; Kurpiewska, Katarzyna; Kalinowska-Tłuścik, Justyna; Dömling, Alexander |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2020 |
Journal volume | 56 |
Journal issue | 73 |
Pages of publication | 10662 - 10665 |
a | 8.3584 ± 0.0006 Å |
b | 8.3584 ± 0.0006 Å |
c | 6.7005 ± 0.0009 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 468.12 ± 0.08 Å3 |
Cell temperature | 130 ± 2 K |
Ambient diffraction temperature | 130 ± 2 K |
Number of distinct elements | 3 |
Space group number | 86 |
Hermann-Mauguin space group symbol | P 42/n :2 |
Hall space group symbol | -P 4bc |
Residual factor for all reflections | 0.0678 |
Residual factor for significantly intense reflections | 0.0665 |
Weighted residual factors for significantly intense reflections | 0.1693 |
Weighted residual factors for all reflections included in the refinement | 0.1706 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.176 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
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/7127006.html
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