Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 8106943
Preview
Coordinates | 8106943.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C16 H19 N3 O |
---|---|
Calculated formula | C16 H19 N3 O |
Title of publication | Crystal structure of N′-(adamantan-2-ylidene)pyridine-3-carbohydrazide, C16H19N3O |
Authors of publication | Al-Tamimi, Abdul-Malek S.; Ghabbour, Hazem A.; El-Emam, Ali A. |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2016 |
Journal volume | 231 |
Journal issue | 2 |
Pages of publication | 573 - 575 |
a | 8.0381 ± 0.0005 Å |
b | 10.4499 ± 0.0008 Å |
c | 17.1228 ± 0.0013 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1438.27 ± 0.18 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P n a 21 |
Hall space group symbol | P 2c -2n |
Residual factor for all reflections | 0.0766 |
Residual factor for significantly intense reflections | 0.0499 |
Weighted residual factors for significantly intense reflections | 0.0995 |
Weighted residual factors for all reflections included in the refinement | 0.1105 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.025 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
---|---|---|---|
281994 (current) | 2023-03-23 | cif/ Adding structures of 8106943 via cif-deposit CGI script. |
8106943.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.