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Information card for entry 4344963
Preview
Coordinates | 4344963.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C27 H24 Cl Co N13 O4 |
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Calculated formula | C27 H24 Cl Co N13 O4 |
SMILES | [Co]123([N](Cc4[n]3nn(c3ccccc3)c4)(Cc3[n]2nn(c2ccccc2)c3)Cc2[n]1nn(c1ccccc1)c2)N=N#N.Cl(=O)(=O)(=O)[O-] |
Title of publication | Control of Complex Formation through Peripheral Substituents in Click-Tripodal Ligands: Structural Diversity in Homo- and Heterodinuclear Cobalt-Azido Complexes. |
Authors of publication | Sommer, Michael G.; Marx, Raphael; Schweinfurth, David; Rechkemmer, Yvonne; Neugebauer, Petr; van der Meer, Margarethe; Hohloch, Stephan; Demeshko, Serhiy; Meyer, Franc; van Slageren, Joris; Sarkar, Biprajit |
Journal of publication | Inorganic chemistry |
Year of publication | 2017 |
Journal volume | 56 |
Journal issue | 1 |
Pages of publication | 402 - 413 |
a | 11.911 ± 0.003 Å |
b | 13.552 ± 0.003 Å |
c | 19.183 ± 0.005 Å |
α | 90° |
β | 106.809 ± 0.005° |
γ | 90° |
Cell volume | 2964.2 ± 1.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0877 |
Residual factor for significantly intense reflections | 0.0587 |
Weighted residual factors for significantly intense reflections | 0.142 |
Weighted residual factors for all reflections included in the refinement | 0.1687 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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