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Information card for entry 7111702
Preview
Coordinates | 7111702.cif |
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Original paper (by DOI) | HTML |
Common name | tetraspirocyclooctyl |
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Formula | C48 H64 S4 |
Calculated formula | C48 H64 S4 |
SMILES | c12ccc(C3(CCCCCCC3)c3ccc(C4(CCCCCCC4)c4ccc(C5(CCCCCCC5)c5ccc(C61CCCCCCC6)s5)s4)s3)s2 |
Title of publication | A novel synthesis of calix[4]thiophenes and calix[4]furans |
Authors of publication | Lee, Gon-Ann; Wang, Wen-Chieh; Shieh, Minghuey; Kuo, Ting-Shen |
Journal of publication | Chemical Communications |
Year of publication | 2010 |
Journal volume | 46 |
Journal issue | 27 |
Pages of publication | 5009 - 5011 |
a | 14.0646 ± 0.0004 Å |
b | 14.0646 ± 0.0004 Å |
c | 21.5443 ± 0.0017 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 4261.7 ± 0.4 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 3 |
Space group number | 78 |
Hermann-Mauguin space group symbol | P 43 |
Hall space group symbol | P 4cw |
Residual factor for all reflections | 0.1234 |
Residual factor for significantly intense reflections | 0.0801 |
Weighted residual factors for significantly intense reflections | 0.1854 |
Weighted residual factors for all reflections included in the refinement | 0.2124 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.082 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7111702.html
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