Crystallography Open Database





Information card for 7151742

7151741 << 7151742 >> 7151743

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Coordinates

7151742.cif

Structure parameters

Formula - C14 H16 O4 -
Calculated formula - C14 H16 O4 -
Title of publication Total synthesis of C19 lipid diols containing a 2,5-disubstituted-3-oxygenated tetrahydrofuran.
Authors of publication Nesbitt, Caroline L.; McErlean, Christopher S. P.
Journal of publication Organic &amp; biomolecular chemistry
Year of publication 2011
Journal volume 9
Journal issue 7
Pages of publication 2198 - 2208
a 5.4822 ± 0.0004 Å
b 8.8469 ± 0.0006 Å
c 24.9538 ± 0.0017 Å
α 90°
β 90°
γ 90°
Cell volume 1210.27 ± 0.15 Å3
Cell temperature 150 ± 2 K
Ambient diffraction temperature 150 ± 2 K
Number of distinct elements 3
Hermann-Mauguin symmetry space group P 21 21 21
Hall symmetry space group P 2ac 2ab
Residual factor for all reflections 0.0334
Residual factor for observed reflections 0.0321
Weighted residual factors for the observed reflections 0.0895
Weighted residual factors for all reflections included in the refinement 0.0908
Goodness-of-fit parameter for observed reflections 1.041
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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