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Information card for entry 7121730
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Coordinates | 7121730.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | methylpropylamine |
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Chemical name | methylpropylamine |
Formula | C4 H11 N |
Calculated formula | C4 H11 N |
Title of publication | The simplest supramolecular helix. |
Authors of publication | Hanke, Felix; Pugh, Chloe J.; Kay, Ellis F.; Taylor, Joshua B.; Todd, Stephen M.; Robertson, Craig M.; Slater, Benjamin J.; Steiner, Alexander |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2018 |
Journal volume | 54 |
Journal issue | 47 |
Pages of publication | 6012 - 6015 |
a | 15.168 ± 0.015 Å |
b | 8.902 ± 0.008 Å |
c | 15.176 ± 0.015 Å |
α | 90° |
β | 90.67 ± 0.02° |
γ | 90° |
Cell volume | 2049 ± 3 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 3 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.1196 |
Residual factor for significantly intense reflections | 0.0892 |
Weighted residual factors for significantly intense reflections | 0.261 |
Weighted residual factors for all reflections included in the refinement | 0.292 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.003 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7121730.html
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structural data.