Information card for entry 2205407
Chemical name |
Nonaaquaneodymium(III) trichloride bis(1,3,5,7-tetraazatricyclo[3.3.1.1^3,7^]decane tetrahydrate |
Formula |
C12 H50 Cl3 N8 Nd O13 |
Calculated formula |
C12 H48 Cl3 N8 Nd O13 |
Title of publication |
Nonaaquaneodymium(III) trichloride bis(1,3,5,7-tetraazatricyclo[3.3.1.1^3,7^]decane tetrahydrate |
Authors of publication |
Trzesowska, Agata; Kruszynski, Rafal; Bartczak, Tadeusz Jan; Zalewicz, Malgorzata |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2005 |
Journal volume |
61 |
Journal issue |
4 |
Pages of publication |
m625 - m628 |
a |
9.8155 ± 0.0006 Å |
b |
11.723 ± 0.0009 Å |
c |
14.0699 ± 0.0012 Å |
α |
85.964 ± 0.006° |
β |
76.178 ± 0.006° |
γ |
80.879 ± 0.006° |
Cell volume |
1551.3 ± 0.2 Å3 |
Cell temperature |
293 ± 2 K |
Ambient diffraction temperature |
293 ± 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 |
0.0271 |
Residual factor for significantly intense reflections |
0.0254 |
Weighted residual factors for significantly intense reflections |
0.0681 |
Weighted residual factors for all reflections included in the refinement |
0.0692 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.087 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
Yes |
Has Fobs |
Yes |
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The link is:
https://www.crystallography.net/2205407.html