Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 8101846
Preview
Coordinates | 8101846.cif |
---|
Chemical name | (N-(2-hydroxyl-1-naphthal)ethylenediamine)(isonicotinyl hydrazide)oxovanadium |
---|---|
Formula | C17 H16 N5 O3 V |
Calculated formula | C19 H18 N5 O3 V |
SMILES | [V]123(Oc4ccc5ccccc5c4C=[N]1CC[NH2]2)([O]=C(N=[NH]3)c1ccncc1)=O |
Title of publication | Crystal structure of (N-(2-hydroxyl-1-naphthal)ethylenediamine)(isonicotinyl hydrazide)oxovanadium(V), [VO(C~6~H~5~N~3~O)(C~13~H~13~N~2~O)] |
Authors of publication | Y.-Z. Zhou; R.-J. Chen; S.-J. Tu; D.-D. Hu |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2005 |
Journal volume | 220 |
Journal issue | 3 |
Pages of publication | 511 - 514 |
a | 14.935 ± 0.002 Å |
b | 7.1297 ± 0.001 Å |
c | 17.573 ± 0.002 Å |
α | 90° |
β | 97.084 ± 0.002° |
γ | 90° |
Cell volume | 1856.9 ± 0.4 Å3 |
Cell temperature | 273 ± 2 K |
Ambient diffraction temperature | 273 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0473 |
Residual factor for significantly intense reflections | 0.0354 |
Weighted residual factors for significantly intense reflections | 0.0916 |
Weighted residual factors for all reflections included in the refinement | 0.0968 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.113 |
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/8101846.html
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.