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Information card for entry 1570704
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Coordinates | 1570704.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | 5,6-Dimethylbenzo[<i>d</i>][1,3]oxatellurole |
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Formula | C9 H10 O Te |
Calculated formula | C9 H10 O Te |
Title of publication | 5,6-Dimethylbenzo[d][1,3]oxatellurole |
Authors of publication | Ponzo, Samantha; Turner, Alanna; Fronczek, Frank R.; Junk, Thomas |
Journal of publication | IUCrData |
Year of publication | 2024 |
Journal volume | 9 |
Journal issue | 1 |
a | 13.6947 ± 0.0012 Å |
b | 23.467 ± 0.002 Å |
c | 5.2287 ± 0.0006 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1680.4 ± 0.3 Å3 |
Cell temperature | 100 ± 0.5 K |
Ambient diffraction temperature | 100 ± 0.5 K |
Number of distinct elements | 4 |
Space group number | 18 |
Hermann-Mauguin space group symbol | P 21 21 2 |
Hall space group symbol | P 2 2ab |
Residual factor for all reflections | 0.0424 |
Residual factor for significantly intense reflections | 0.033 |
Weighted residual factors for significantly intense reflections | 0.0585 |
Weighted residual factors for all reflections included in the refinement | 0.0609 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.054 |
Diffraction radiation wavelength | 0.56086 Å |
Diffraction radiation type | AgKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
288715 (current) | 2024-01-06 | cif/ Adding structures of 1570704 via cif-deposit CGI script. |
1570704.cif |
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