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Information card for entry 7216072
Preview
Coordinates | 7216072.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C4 H9 N3 O5 S Zn |
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Calculated formula | C4 H9 N3 O5 S Zn |
Title of publication | The structural influence of ligand coordination and hydrogen bonding capabilities in the crystal engineering of metal thiosemicarbazide compounds with malonate |
Authors of publication | Burrows, Andrew D.; Harrington, Ross W.; Mahon, Mary F.; Teat, Simon J. |
Journal of publication | CrystEngComm |
Year of publication | 2005 |
Journal volume | 7 |
Journal issue | 64 |
Pages of publication | 388 |
a | 9.194 ± 0.0005 Å |
b | 11.037 ± 0.0007 Å |
c | 9.283 ± 0.0006 Å |
α | 90° |
β | 107.528 ± 0.004° |
γ | 90° |
Cell volume | 898.25 ± 0.1 Å3 |
Cell temperature | 170 ± 2 K |
Ambient diffraction temperature | 170 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/a 1 |
Hall space group symbol | -P 2yab |
Residual factor for all reflections | 0.0317 |
Residual factor for significantly intense reflections | 0.0299 |
Weighted residual factors for significantly intense reflections | 0.0778 |
Weighted residual factors for all reflections included in the refinement | 0.0796 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.086 |
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/7216072.html
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