Information card for entry 2214907
Chemical name |
<i>trans</i>-Bis[2-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)phenolato-\ κ^2^<i>N</i>,<i>O</i>^1^]nickel(II) |
Formula |
C22 H24 N2 Ni O4 |
Calculated formula |
C22 H24 N2 Ni O4 |
SMILES |
c12ccccc1C1=[N]([Ni]3(O2)[N]2=C(c4c(cccc4)O3)OC[C@@H]2CC)[C@@H](CO1)CC |
Title of publication |
<i>trans</i>-Bis[2-(4-ethyl-4,5-dihydro-1,3-oxazol-2-yl)phenolato-κ^2^<i>N</i>,<i>O</i>^1^]nickel(II) |
Authors of publication |
Zhang, Yan; Liu, Tian-Fu; Xu, Wen-Guo |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2007 |
Journal volume |
63 |
Journal issue |
8 |
Pages of publication |
m2231 - m2231 |
a |
6.8507 ± 0.0008 Å |
b |
14.2231 ± 0.0016 Å |
c |
10.4333 ± 0.0011 Å |
α |
90° |
β |
94.978 ± 0.001° |
γ |
90° |
Cell volume |
1012.8 ± 0.2 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 |
0.032 |
Residual factor for significantly intense reflections |
0.027 |
Weighted residual factors for significantly intense reflections |
0.074 |
Weighted residual factors for all reflections included in the refinement |
0.078 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.04 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
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The link is:
https://www.crystallography.net/2214907.html