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Information card for entry 7027633
Preview
Coordinates | 7027633.cif |
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Original paper (by DOI) | HTML |
Formula | C14 H32 Cu N10 |
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Calculated formula | C14 H32 Cu N10 |
SMILES | C1[NH]2[C@H](CC[N]3([Cu]42([N](C1)(CC[C@@H](C)[NH]4CC3)C)(N=N#N)N=N#N)C)C |
Title of publication | Copper(II) complexes of C-meso-1,5,8,12-tetramethyl-1,4,8,11-tetraazacyclotetradecane: syntheses, structures and properties †> |
Authors of publication | Lu, Tian-Huey; Lin, Shih-Chi; Aneetha, Halikhedkar; Panneerselvam, Kaliyamoorthy; Chung, Chung-Sun |
Journal of publication | Journal of the Chemical Society, Dalton Transactions |
Year of publication | 1999 |
Journal issue | 19 |
Pages of publication | 3385 |
a | 7.3939 ± 0.0001 Å |
b | 16.1227 ± 0.0003 Å |
c | 8.5698 ± 0.0002 Å |
α | 90° |
β | 114.381 ± 0.001° |
γ | 90° |
Cell volume | 930.5 ± 0.03 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/a 1 |
Hall space group symbol | -P 2yab |
Residual factor for all reflections | 0.0567 |
Residual factor for significantly intense reflections | 0.0396 |
Weighted residual factors for significantly intense reflections | 0.1004 |
Weighted residual factors for all reflections included in the refinement | 0.109 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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