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Information card for entry 7703001
Preview
| Coordinates | 7703001.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Common name | AL_II_025 |
|---|---|
| Formula | C39 H48 N11 V |
| Calculated formula | C39 H48 N11 V |
| Title of publication | Synthesis, characterization, DFT calculations, and reactivity study of a nitrido-bridged dimeric vanadium(iv) complex. |
| Authors of publication | Lugosan, Adriana; Cundari, Thomas; Fleming, Kristin; Dickie, Diane A.; Zeller, Matthias; Ghannam, Jack; Lee, Wei-Tsung |
| Journal of publication | Dalton transactions (Cambridge, England : 2003) |
| Year of publication | 2020 |
| Journal volume | 49 |
| Journal issue | 4 |
| Pages of publication | 1200 - 1206 |
| a | 15.0518 ± 0.0004 Å |
| b | 14.5044 ± 0.0004 Å |
| c | 17.2485 ± 0.0004 Å |
| α | 90° |
| β | 92.868 ± 0.002° |
| γ | 90° |
| Cell volume | 3760.93 ± 0.17 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 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 | 0.0794 |
| Residual factor for significantly intense reflections | 0.0462 |
| Weighted residual factors for significantly intense reflections | 0.0982 |
| Weighted residual factors for all reflections included in the refinement | 0.1119 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.017 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301878 (current) | 2025-08-23 | Add cross-references to PubChem compounds in COD range 7/70/ Each referenced PubChem compound corresponds to the full crystal structure. |
7703001.cif |
| 247721 | 2020-02-04 | cif/ Updating files of 7702999, 7703000, 7703001, 7703002 Original log message: Adding full bibliography for 7702999--7703002.cif. |
7703001.cif |
| 245367 | 2019-12-19 | cif/ Adding structures of 7702999, 7703000, 7703001, 7703002 via cif-deposit CGI script. |
7703001.cif |
All data in the COD and the database itself are dedicated to the
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Users of the data should acknowledge the original authors of the
structural data.