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Information card for entry 2241260
Preview
Coordinates | 2241260.cif |
---|---|
Structure factors | 2241260.hkl |
Original IUCr paper | HTML |
Chemical name | μ-Oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^-bis[[4-(2-aminoethyl)-1<i>H</i>-imidazole-κ^2^<i>N</i>^3^,<i>N</i>^4^](dicyanamido-κ<i>N</i>^1^)copper(II)] |
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Formula | C16 H18 Cu2 N12 O4 |
Calculated formula | C15.996 H17.988 Cu2 N12 O4 |
Title of publication | Crystal structures of μ-oxalato-bis[azido(histamine)copper(II)] and μ-oxalato-bis[(dicyanamido)(histamine)copper(II)] |
Authors of publication | Liu, Chen; Abboud, Khalil A. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2015 |
Journal volume | 71 |
Journal issue | 11 |
Pages of publication | 1379 - 1383 |
a | 9.6816 ± 0.0007 Å |
b | 14.7236 ± 0.0011 Å |
c | 7.4604 ± 0.0006 Å |
α | 90° |
β | 90.112 ± 0.001° |
γ | 90° |
Cell volume | 1063.46 ± 0.14 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 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 | 0.0364 |
Residual factor for significantly intense reflections | 0.0338 |
Weighted residual factors for significantly intense reflections | 0.0944 |
Weighted residual factors for all reflections included in the refinement | 0.0956 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.146 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | Yes |
Revision | Date | Message | Files |
---|---|---|---|
181913 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/12. |
2241260.cif 2241260.hkl |
169849 | 2015-10-29 | cif/ hkl/ Adding structures of 2241259, 2241260 via cif-deposit CGI script. |
2241260.cif 2241260.hkl |
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Users of the data should acknowledge the original authors of the
structural data.