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Information card for entry 1553425
Preview
Coordinates | 1553425.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C155 H166 Cl22 F24 N12 O12 P4 Ru2 |
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Calculated formula | C144 H144 F24 N12 O12 P4 Ru2 |
Title of publication | Conformations of large macrocycles and ring-in-ring complexes |
Authors of publication | Klosterman, Jeremy K.; Veliks, Janis; Frantz, Derik K.; Yasui, Yoshizumi; Loepfe, Michael; Zysman-Colman, Eli; Linden, Anthony; Siegel, Jay S. |
Journal of publication | Organic Chemistry Frontiers |
Year of publication | 2016 |
Journal volume | 3 |
Journal issue | 6 |
Pages of publication | 661 |
a | 15.004 ± 0.0005 Å |
b | 15.1525 ± 0.0004 Å |
c | 21.5611 ± 0.0007 Å |
α | 98.4023 ± 0.0018° |
β | 98.0121 ± 0.0012° |
γ | 108.321 ± 0.002° |
Cell volume | 4512.9 ± 0.3 Å3 |
Cell temperature | 160 ± 1 K |
Ambient diffraction temperature | 160 ± 1 K |
Number of distinct elements | 8 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0964 |
Residual factor for significantly intense reflections | 0.0627 |
Weighted residual factors for significantly intense reflections | 0.1493 |
Weighted residual factors for all reflections included in the refinement | 0.1674 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/1553425.html
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