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Information card for entry 7038706
Preview
| Coordinates | 7038706.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 2-Dy |
|---|---|
| Chemical name | [(C5Me4H)2(THF)Dy]2(μ-η2:η2-N2) |
| Formula | C44 H68 Dy2 N2 O2 |
| Calculated formula | C44 H68 Dy2 N2 O2 |
| SMILES | [c]12([c]3([cH]4[Dy]56789%1013([O]1CCCC1)([c]1([c]5([c]9([c]%10([cH]61)C)C)C)C)([c]4([c]27C)C)[N]1=[N]8[Dy]234567891([c]1([c]2([c]3([c]4([cH]51)C)C)C)C)([O]1CCCC1)[c]1([c]6([c]7([c]8([cH]91)C)C)C)C)C)C |
| Title of publication | Raman spectroscopy of the N-N bond in rare earth dinitrogen complexes. |
| Authors of publication | Fieser, Megan E.; Woen, David H.; Corbey, Jordan F.; Mueller, Thomas J.; Ziller, Joseph W.; Evans, William J. |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2016 |
| Journal volume | 45 |
| Journal issue | 37 |
| Pages of publication | 14634 - 14644 |
| a | 15.7376 ± 0.0015 Å |
| b | 14.1959 ± 0.0014 Å |
| c | 18.9717 ± 0.0018 Å |
| α | 90° |
| β | 101.218 ± 0.0011° |
| γ | 90° |
| Cell volume | 4157.5 ± 0.7 Å3 |
| Cell temperature | 133 ± 2 K |
| Ambient diffraction temperature | 133 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0369 |
| Residual factor for significantly intense reflections | 0.0316 |
| Weighted residual factors for significantly intense reflections | 0.0767 |
| Weighted residual factors for all reflections included in the refinement | 0.079 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.078 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 187134 (current) | 2016-10-08 | cif/ Updating files of 7038699, 7038700, 7038701, 7038702, 7038703, 7038704, 7038705, 7038706, 7038707, 7038708 Original log message: Adding full bibliography for 7038699--7038708.cif. |
7038706.cif |
| 177621 | 2016-03-05 | cif/ Adding structures of 7038699, 7038700, 7038701, 7038702, 7038703, 7038704, 7038705, 7038706, 7038707, 7038708 via cif-deposit CGI script. |
7038706.cif |
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Users of the data should acknowledge the original authors of the
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