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Information card for entry 7243534
Preview
Coordinates | 7243534.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | 2,3-bis(3-iodophenyl)quinoxaline |
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Formula | C20 H12 I2 N2 |
Calculated formula | C20 H12 I2 N2 |
Title of publication | Isostructurality of quinoxaline crystal phases: the interplay of weak hydrogen bonds and halogen bonding |
Authors of publication | Saidykhan, Amie; Fenwick, Nathan W.; Bowen, Richard D.; Telford, Richard; Seaton, Colin C. |
Journal of publication | CrystEngComm |
Year of publication | 2021 |
Journal volume | 23 |
Journal issue | 40 |
Pages of publication | 7108 - 7117 |
a | 8.6398 ± 0.0005 Å |
b | 19.4072 ± 0.001 Å |
c | 10.7039 ± 0.0006 Å |
α | 90° |
β | 101.237 ± 0.003° |
γ | 90° |
Cell volume | 1760.36 ± 0.17 Å3 |
Cell temperature | 99.87 K |
Ambient diffraction temperature | 99.87 K |
Number of distinct elements | 4 |
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 | 0.0854 |
Residual factor for significantly intense reflections | 0.0461 |
Weighted residual factors for significantly intense reflections | 0.0947 |
Weighted residual factors for all reflections included in the refinement | 0.1067 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
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/7243534.html
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