Crystallography Open Database

Information card for entry 7126593

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Coordinates	7126593.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H24 O5 P
Calculated formula	C22 H25 O5 P
Title of publication	Access to enantioenriched 4-phosphorylated δ-lactones from β-phosphorylenones and enals via carbene organocatalysis.
Authors of publication	Verma, Ram Subhawan; Khatana, Anil Kumar; Mishra, Monika; Kumar, Shailesh; Tiwari, Bhoopendra
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2020
Journal volume	56
Journal issue	52
Pages of publication	7155 - 7158
a	10.2137 ± 0.0018 Å
b	9.2639 ± 0.0015 Å
c	11.792 ± 0.002 Å
α	90°
β	110.27 ± 0.005°
γ	90°
Cell volume	1046.6 ± 0.3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 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	0.1151
Residual factor for significantly intense reflections	0.0483
Weighted residual factors for significantly intense reflections	0.08
Weighted residual factors for all reflections included in the refinement	0.095
Goodness-of-fit parameter for all reflections included in the refinement	1.014
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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