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Information card for entry 4032293
Preview
Coordinates | 4032293.cif |
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Original paper (by DOI) | HTML |
Formula | C82 H64 Cl4 O4 |
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Calculated formula | C80 H60 O4 |
Title of publication | Synthesis of Partially Hydrogenated Cycloparaphenylenes with Bent and Fused Structures Bearing Armchair Carbon Nanotube-like Connections. |
Authors of publication | Huang, Changfeng; Li, Shuangjiang; Thakellapalli, Haresh; Farajidizaji, Behzad; Huang, Yiwei; Akhmedov, Novruz G.; Popp, Brian V.; Petersen, Jeffrey L.; Wang, Kung K. |
Journal of publication | The Journal of organic chemistry |
Year of publication | 2017 |
Journal volume | 82 |
Journal issue | 2 |
Pages of publication | 1166 - 1174 |
a | 8.4681 ± 0.0006 Å |
b | 13.0884 ± 0.0009 Å |
c | 14.0333 ± 0.0009 Å |
α | 84.5629 ± 0.0019° |
β | 78.6719 ± 0.0019° |
γ | 77.9988 ± 0.0018° |
Cell volume | 1489.37 ± 0.18 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1457 |
Residual factor for significantly intense reflections | 0.0981 |
Weighted residual factors for significantly intense reflections | 0.2133 |
Weighted residual factors for all reflections included in the refinement | 0.2421 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.058 |
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/4032293.html
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