Crystallography Open Database

Information card for entry 7125001

Preview

Coordinates	7125001.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H18 Br Sb
Calculated formula	C24 H18 Br Sb
Title of publication	Increasing the Brønsted acidity of Ph2PO2H by the Lewis acid B(C6F5)3. Formation of an eight-membered boraphosphinate ring [Ph2POB(C6F5)2O]2.
Authors of publication	Kather, Ralf; Rychagova, Elena; Sanz Camacho, Paula; Ashbrook, Sharon E.; Woollins, J. Derek; Robben, Lars; Lork, Enno; Ketkov, Sergey; Beckmann, Jens
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2016
Journal volume	52
Journal issue	73
Pages of publication	10992 - 10995
a	10.9265 ± 0.0003 Å
b	8.5022 ± 0.0002 Å
c	20.5734 ± 0.0006 Å
α	90°
β	93.534 ± 0.001°
γ	90°
Cell volume	1907.62 ± 0.09 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0384
Residual factor for significantly intense reflections	0.0254
Weighted residual factors for significantly intense reflections	0.0503
Weighted residual factors for all reflections included in the refinement	0.0539
Goodness-of-fit parameter for all reflections included in the refinement	1.058
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
234423 (current)	2019-11-23	cif/ Adding structures of 7124999, 7125000, 7125001, 7125002, 7125003, 7125004, 7125005, 7125006, 7125007, 7125008, 7125009, 7125010, 7125011, 7125012, 7125013, 7125014, 7125015 via cif-deposit CGI script.	7125001.cif