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Information card for entry 7035541
Preview
Coordinates | 7035541.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | zinccarboxylate |
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Formula | C53 H38 N2 O20 S3 Zn3 |
Calculated formula | C53 H38 N2 O20 S3 Zn3 |
Title of publication | The effect of cluster size on the optical band gap energy of Zn-based metal-organic frameworks. |
Authors of publication | Ghosh, Raja; Pedicini, Anthony F.; Rao, Purna Chandra; Asha, K. S.; Reber, Arthur C.; Mandal, Sukhendu |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2015 |
Journal volume | 44 |
Journal issue | 30 |
Pages of publication | 13464 - 13468 |
a | 16.3303 ± 0.0004 Å |
b | 20.6847 ± 0.0005 Å |
c | 16.9801 ± 0.0004 Å |
α | 90° |
β | 98.472 ± 0.001° |
γ | 90° |
Cell volume | 5673.1 ± 0.2 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 6 |
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 | 0.1173 |
Residual factor for significantly intense reflections | 0.0639 |
Weighted residual factors for significantly intense reflections | 0.1734 |
Weighted residual factors for all reflections included in the refinement | 0.2129 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
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/7035541.html
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