Information card for entry 7709492
Formula |
C99 H76 N16 O61 Ti15 |
Calculated formula |
C99 H76 N16 O61 Ti15 |
Title of publication |
Syntheses, structures and ligand binding modes of titanium-oxide complexes of 2-picolinate |
Authors of publication |
Gao, Chang; Liu, Caiyun; Said, Amir; Niu, Huihui; Wang, Dexin; Wang, Guo; Tung, Chen-Ho; Wang, Yifeng |
Journal of publication |
Dalton Transactions |
Year of publication |
2022 |
a |
15.9539 ± 0.0006 Å |
b |
17.4707 ± 0.0009 Å |
c |
29.0128 ± 0.0009 Å |
α |
89.709 ± 0.003° |
β |
80.24 ± 0.003° |
γ |
81.263 ± 0.004° |
Cell volume |
7875.3 ± 0.6 Å3 |
Cell temperature |
172.99 ± 0.1 K |
Ambient diffraction temperature |
172.99 ± 0.1 K |
Number of distinct elements |
5 |
Space group number |
2 |
Hermann-Mauguin space group symbol |
P -1 |
Hall space group symbol |
-P 1 |
Residual factor for all reflections |
0.159 |
Residual factor for significantly intense reflections |
0.0831 |
Weighted residual factors for significantly intense reflections |
0.2232 |
Weighted residual factors for all reflections included in the refinement |
0.2729 |
Goodness-of-fit parameter for all reflections included in the refinement |
0.944 |
Diffraction radiation probe |
x-ray |
Diffraction radiation wavelength |
1.54184 Å |
Diffraction radiation type |
CuKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
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https://www.crystallography.net/7709492.html