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Information card for entry 4086168
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Jmol._Canvas2D (Jmol) "jmolApplet0"[x]
Coordinates | 4086168.cif |
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Original paper (by DOI) | HTML |
Formula | C28.5 H44 Mg N4 Si |
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Calculated formula | C28.5 H44 Mg N4 Si |
SMILES | [Mg]123456([n]7n(c(cc7C)C)C(n7[n]1c(cc7C)C)C([c]12[cH]3[cH]4[cH]5[cH]61)C(C)(C)C)C[Si](C)(C)C.c1(ccccc1)C |
Title of publication | New Racemic and Single Enantiopure Hybrid Scorpionate/Cyclopentadienyl Magnesium and Zinc Initiators for the Stereoselective ROP of Lactides |
Authors of publication | Honrado, Manuel; Otero, Antonio; Fernández-Baeza, Juan; Sánchez-Barba, Luis F.; Garcés, Andrés; Lara-Sánchez, Agustín; Martínez-Ferrer, Jaime; Sobrino, Sonia; Rodríguez, Ana M. |
Journal of publication | Organometallics |
Year of publication | 2015 |
Journal volume | 34 |
Journal issue | 13 |
Pages of publication | 3196 |
a | 19.103 ± 0.0014 Å |
b | 24.4642 ± 0.0017 Å |
c | 25.053 ± 0.0019 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 11708.3 ± 1.5 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 5 |
Space group number | 61 |
Hermann-Mauguin space group symbol | P b c a |
Hall space group symbol | -P 2ac 2ab |
Residual factor for all reflections | 0.075 |
Residual factor for significantly intense reflections | 0.0413 |
Weighted residual factors for significantly intense reflections | 0.1097 |
Weighted residual factors for all reflections included in the refinement | 0.1205 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.883 |
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/4086168.html
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Users of the data should acknowledge the original authors of the
structural data.