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Information card for entry 4115850
Preview
Coordinates | 4115850.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C22 H33 N O Sn |
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Calculated formula | C22 H33 N O Sn |
SMILES | [Sn](C(C)c1ccc2ccccc2c1C(=O)N(C(C)C)C(C)C)(C)(C)C |
Title of publication | Stereospecificity and Stereoselectivity in Electrophilic Substitution Reactions of Non-α-Heterosubstituted Organolithiums and Stannanes: A Rotationally Restricted Amide as an Internal Stereochemical Marker |
Authors of publication | Jonathan Clayden; Madeleine Helliwell; Jennifer H. Pink; Neil Westlund |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2001 |
Journal volume | 123 |
Pages of publication | 12449 - 12457 |
a | 7.694 Å |
b | 13.465 Å |
c | 22.077 Å |
α | 90° |
β | 97.1° |
γ | 90° |
Cell volume | 2269.63 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0531 |
Residual factor for significantly intense reflections | 0.0365 |
Weighted residual factors for significantly intense reflections | 0.097 |
Weighted residual factors for all reflections included in the refinement | 0.1058 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.074 |
Diffraction radiation wavelength | 0.71069 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/4115850.html
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