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Information card for entry 7249011
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Coordinates | 7249011.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C18 H15 Cl5 N12 Zn |
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Calculated formula | C18 H15 Cl5 N12 Zn |
Title of publication | Crystallographic insight into the binding modes of group 12 metal cations with N7-alkylated purines |
Authors of publication | Panda, Subhra Jyoti; Agrawalla, Suraj Kumar; Purohit, Chandra Shekhar |
Journal of publication | CrystEngComm |
Year of publication | 2024 |
Journal volume | 26 |
Journal issue | 33 |
Pages of publication | 4418 - 4430 |
a | 6.9888 ± 0.0002 Å |
b | 10.2584 ± 0.0004 Å |
c | 18.2501 ± 0.0006 Å |
α | 102.553 ± 0.003° |
β | 90.641 ± 0.003° |
γ | 108.11 ± 0.003° |
Cell volume | 1209.5 ± 0.08 Å3 |
Cell temperature | 100 ± 0.1 K |
Ambient diffraction temperature | 100 ± 0.1 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0513 |
Residual factor for significantly intense reflections | 0.0367 |
Weighted residual factors for significantly intense reflections | 0.0774 |
Weighted residual factors for all reflections included in the refinement | 0.0822 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
Diffraction radiation probe | x-ray |
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/7249011.html
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structural data.