Crystallography Open Database

Information card for entry 7121254

Preview

Coordinates	7121254.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H59 Cl3 P2 W
Calculated formula	C32 H59 Cl3 P2 W
Title of publication	An unusual alkylidyne homologation.
Authors of publication	Han, Yong-Shen; Hill, Anthony F.; Kong, Richard Y.
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2018
Journal volume	54
Journal issue	18
Pages of publication	2292 - 2295
a	14.7156 ± 0.0004 Å
b	23.4584 ± 0.0006 Å
c	23.8845 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	8245 ± 0.4 Å³
Cell temperature	150 ± 0.1 K
Ambient diffraction temperature	150 ± 0.1 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0718
Residual factor for significantly intense reflections	0.0525
Weighted residual factors for significantly intense reflections	0.1224
Weighted residual factors for all reflections included in the refinement	0.1335
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
228445 (current)	2019-11-17	cif/ Updating files of 7121252, 7121253, 7121254, 7121255 Original log message: Adding full bibliography for 7121252--7121255.cif.	7121254.cif
206281	2018-02-08	cif/ Adding structures of 7121252, 7121253, 7121254, 7121255 via cif-deposit CGI script.	7121254.cif