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Information card for entry 7058379
Preview
Coordinates | 7058379.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H38 F N Na O3 P Se |
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Calculated formula | C30 H38 F N Na O3 P Se |
SMILES | [O]1(CCCC1)[Na]1([O]2CCCC2)([O]2CCCC2)N(c2c([F]1)cccc2)P(c1ccccc1)(c1ccccc1)=[Se] |
Title of publication | Alkali metal complex-mediated ring-opening polymerization of rac-LA, ε-caprolactone, and δ-valerolactone |
Authors of publication | Harinath, Adimulam; Bhattacharjee, Jayeeta; Sarkar, Alok; Panda, Tarun K. |
Journal of publication | New Journal of Chemistry |
Year of publication | 2019 |
Journal volume | 43 |
Journal issue | 23 |
Pages of publication | 8882 |
a | 9.9424 ± 0.0017 Å |
b | 15.5693 ± 0.0007 Å |
c | 10.617 ± 0.005 Å |
α | 90° |
β | 113.65 ± 0.04° |
γ | 90° |
Cell volume | 1505.4 ± 0.9 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 8 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.0401 |
Residual factor for significantly intense reflections | 0.0358 |
Weighted residual factors for significantly intense reflections | 0.0878 |
Weighted residual factors for all reflections included in the refinement | 0.0912 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.08 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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