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Information card for entry 7131900
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 7131900.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | orthorhombic |
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Formula | C5 H7 N3 |
Calculated formula | C5 H7 N3 |
Title of publication | Copper-catalysed dehydrogenative self-coupling/cyclization of 5-aminopyrazoles: synthesis and photophysical study of pyridazines. |
Authors of publication | Rastogi, Gaurav K.; Deb, Mohit L.; Baruah, Pranjal K. |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2023 |
Journal volume | 59 |
Journal issue | 63 |
Pages of publication | 9642 - 9645 |
a | 21.861 ± 0.006 Å |
b | 6.7837 ± 0.0016 Å |
c | 7.501 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1112.4 ± 0.5 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 3 |
Space group number | 60 |
Hermann-Mauguin space group symbol | P b c n |
Hall space group symbol | -P 2n 2ab |
Residual factor for all reflections | 0.1356 |
Residual factor for significantly intense reflections | 0.0835 |
Weighted residual factors for significantly intense reflections | 0.208 |
Weighted residual factors for all reflections included in the refinement | 0.2484 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.113 |
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/7131900.html
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