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Information card for entry 4021989
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Coordinates | 4021989.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | 5-(2,6-di(phenylazo)-phenyl)-10,15,20-tri(2,4,6- trimethoxyphenyl)-porphyrin-acetonitrile-zinc(ii) acetonitrile cyclohexane solute |
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Formula | C71.25 H64.5 N10 O9 Zn |
Calculated formula | C71.25 H59.25 N10 O9 Zn |
Title of publication | Synthesis and Characterization of Azobenzene-Confined Porphyrins |
Authors of publication | Maike V. Peters; Richard Goddard; Stefan Hecht |
Journal of publication | Journal of Organic Chemistry |
Year of publication | 2006 |
Journal volume | 71 |
Pages of publication | 7846 - 7849 |
a | 16.309 ± 0.006 Å |
b | 27.606 ± 0.01 Å |
c | 15.201 ± 0.005 Å |
α | 90° |
β | 103.276 ± 0.01° |
γ | 90° |
Cell volume | 6661 ± 4 Å3 |
Cell temperature | 100 K |
Ambient diffraction temperature | 100 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 | 0.1793 |
Residual factor for significantly intense reflections | 0.1004 |
Weighted residual factors for significantly intense reflections | 0.254 |
Weighted residual factors for all reflections included in the refinement | 0.3119 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/4021989.html
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