Crystallography Open Database

Information card for entry 7126883

Preview

Coordinates	7126883.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C70 H66 F6 N O8.5 P4 Ru S2
Calculated formula	C70 H66 F6 N O8.5 P4 Ru S2
Title of publication	Conventional and unconventional alkyne activations by Ru and Os for unprecedented dimetalated quinolizinium complexes.
Authors of publication	Yeung, Chi-Fung; Chung, Lai-Hon; Tse, Sheung-Ying; Shek, Hau-Lam; Tse, Man-Kit; Yiu, Shek-Man; Wong, Chun-Yuen
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2020
Journal volume	56
Journal issue	63
Pages of publication	8908 - 8911
a	22.978 ± 0.0008 Å
b	16.4419 ± 0.0006 Å
c	36.9317 ± 0.0013 Å
α	90°
β	104 ± 0.001°
γ	90°
Cell volume	13538.4 ± 0.8 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	8
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	0.0976
Residual factor for significantly intense reflections	0.0939
Weighted residual factors for significantly intense reflections	0.2618
Weighted residual factors for all reflections included in the refinement	0.2635
Goodness-of-fit parameter for all reflections included in the refinement	1.089
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
255956 (current)	2020-09-06	cif/ Updating files of 7126879, 7126880, 7126881, 7126882, 7126883, 7126884, 7126885 Original log message: Adding full bibliography for 7126879--7126885.cif.	7126883.cif
254223	2020-07-12	cif/ Adding structures of 7126879, 7126880, 7126881, 7126882, 7126883, 7126884, 7126885 via cif-deposit CGI script.	7126883.cif