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Information card for entry 4122351
Preview
Coordinates | 4122351.cif |
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Original paper (by DOI) | HTML |
Formula | C130 H164 F42 N20 O28 P7 Pt2 S10 |
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Calculated formula | C130 H164 F42 N20 O28 P7 Pt2 S10 |
Title of publication | Mechanical bonds and topological effects in radical dimer stabilization. |
Authors of publication | Frasconi, Marco; Kikuchi, Takashi; Cao, Dennis; Wu, Yilei; Liu, Wei-Guang; Dyar, Scott M.; Barin, Gokhan; Sarjeant, Amy A.; Stern, Charlotte L.; Carmieli, Raanan; Wang, Cheng; Wasielewski, Michael R.; Goddard, 3rd, William A; Stoddart, J. Fraser |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2014 |
Journal volume | 136 |
Journal issue | 31 |
Pages of publication | 11011 - 11026 |
a | 13.8756 ± 0.0005 Å |
b | 17.1561 ± 0.0007 Å |
c | 21.5948 ± 0.0008 Å |
α | 72.636 ± 0.002° |
β | 71.569 ± 0.002° |
γ | 68.962 ± 0.001° |
Cell volume | 4451.5 ± 0.3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 99.96 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 | 0.0753 |
Residual factor for significantly intense reflections | 0.0645 |
Weighted residual factors for significantly intense reflections | 0.1744 |
Weighted residual factors for all reflections included in the refinement | 0.1857 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.112 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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