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Information card for entry 7104498
Preview
Coordinates | 7104498.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | Parquette 1673 |
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Formula | C43 H43 N7 O4 |
Calculated formula | C43 H43 N7 O4 |
SMILES | c1(cccc(C(=O)Nc2ccccc2NC(=O)[C@@H]2CCCN2Cc2ccccc2)n1)C(=O)Nc1ccccc1NC(=O)[C@@H]1CCCN1Cc1ccccc1 |
Title of publication | Direct aldol reactions catalyzed by intramolecularly folded prolinamide dendrons: dendrimer effects on stereoselectivity. |
Authors of publication | Mitsui, Kazuhiko; Hyatt, Sarah A; Turner, Daniel A; Hadad, Christopher M; Parquette, Jon R |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2009 |
Journal volume | 34 |
Journal issue | 22 |
Pages of publication | 3261 - 3263 |
a | 9.7376 ± 0.0001 Å |
b | 18.8927 ± 0.0002 Å |
c | 10.8852 ± 0.0001 Å |
α | 90° |
β | 108.797 ± 0.001° |
γ | 90° |
Cell volume | 1895.74 ± 0.03 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 4 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0486 |
Residual factor for significantly intense reflections | 0.0352 |
Weighted residual factors for significantly intense reflections | 0.0734 |
Weighted residual factors for all reflections included in the refinement | 0.078 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
Diffraction radiation probe | x-ray |
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/7104498.html
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