Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 1520056
Preview
| Coordinates | 1520056.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | Complex6 |
|---|---|
| Formula | C31.5 H48 Cl4 N6 Nb2 O2 |
| Calculated formula | C31.5 H48 Cl4 N6 Nb2 O2 |
| Title of publication | Reduction of ((t)BuN═)NbCl3(py)2 in a Salt-Free Manner for Generating Nb(IV) Dinuclear Complexes and Their Reactivity toward Benzo[c]cinnoline. |
| Authors of publication | Saito, Teruhiko; Nishiyama, Haruka; Kawakita, Kento; Nechayev, Michael; Kriegel, Benjamin; Tsurugi, Hayato; Arnold, John; Mashima, Kazushi |
| Journal of publication | Inorganic chemistry |
| Year of publication | 2015 |
| Journal volume | 54 |
| Journal issue | 12 |
| Pages of publication | 6004 - 6009 |
| a | 8.4679 ± 0.0005 Å |
| b | 15.5173 ± 0.0009 Å |
| c | 15.6028 ± 0.0009 Å |
| α | 90.009 ± 0.004° |
| β | 92.687 ± 0.004° |
| γ | 92.922 ± 0.004° |
| Cell volume | 2045.3 ± 0.2 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.108 |
| Residual factor for significantly intense reflections | 0.0627 |
| Weighted residual factors for significantly intense reflections | 0.1603 |
| Weighted residual factors for all reflections included in the refinement | 0.1894 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176429 (current) | 2016-02-13 | cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary. |
1520056.cif |
| 140092 | 2015-07-05 | cif/ Updating files of 1520054, 1520055, 1520056, 1520057 Original log message: Adding full bibliography for 1520054--1520057.cif. |
1520056.cif |
| 137494 | 2015-05-29 | cif/ Adding structures of 1520054, 1520055, 1520056, 1520057 via cif-deposit CGI script. |
1520056.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.