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Information card for entry 4082049
Preview
Coordinates | 4082049.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C114 H84 Li2 Mg2 N12 O6 |
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Calculated formula | C114 H84 Li2 Mg2 N12 O6 |
SMILES | [N]1(c2ccccc2)=Nc2c(ccc3c2cccc3)[O]([Li]234)[Mg]156([O]([Li]178)c9ccc%10c(c9N=[N]5c5ccccc5)cccc%10)[O]2(c2ccc5c(c2/[N]3=N/c2ccccc2)cccc5)[Mg]23([O]4c4c(c5c(cc4)cccc5)N=[N]2c2ccccc2)([O]1c1ccc2c(c1N=[N]3c3ccccc3)cccc2)[O]67c1ccc2c(c1/[N]8=N/c1ccccc1)cccc2.c1ccccc1.c1ccccc1.c1ccccc1 |
Title of publication | Synthesis and Structure of Homo- and Heterometallic Lithium‒Magnesium Complexes and Their Reactivity in the ROP ofrac-Lactide |
Authors of publication | Gallegos, Carlos; Tabernero, Vanessa; Garc\?ía-Valle, Francisco M.; Mosquera, Marta E. G.; Cuenca, Tomás; Cano, Jesús |
Journal of publication | Organometallics |
Year of publication | 2013 |
Journal volume | 32 |
Journal issue | 21 |
Pages of publication | 6624 |
a | 12.532 ± 0.0008 Å |
b | 14.1422 ± 0.0008 Å |
c | 15.7838 ± 0.001 Å |
α | 115.283 ± 0.004° |
β | 91.199 ± 0.007° |
γ | 111.28 ± 0.005° |
Cell volume | 2305 ± 0.3 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1528 |
Residual factor for significantly intense reflections | 0.0699 |
Weighted residual factors for significantly intense reflections | 0.1801 |
Weighted residual factors for all reflections included in the refinement | 0.2548 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.07 |
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/4082049.html
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