Crystallography Open Database

Information card for entry 7121757

Preview

Coordinates	7121757.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C76 H70 Cl6 P4 Rh4 S4
Calculated formula	C76 H70 Cl6 P4 Rh4 S4
Title of publication	Synthesis of Rh(iii) thiophosphinito pincer hydrido complexes by base-free C-H bond activation at room temperature.
Authors of publication	Vlahopoulou, G.; Möller, S; Haak, J.; Hasche, P.; Drexler, H.-J.; Heller, D.; Beweries, T.
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2018
Journal volume	54
Journal issue	49
Pages of publication	6292 - 6295
a	12.0429 ± 0.0003 Å
b	13.0157 ± 0.0003 Å
c	45.0034 ± 0.0012 Å
α	90°
β	90.985 ± 0.001°
γ	90°
Cell volume	7053.1 ± 0.3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0486
Residual factor for significantly intense reflections	0.0398
Weighted residual factors for significantly intense reflections	0.099
Weighted residual factors for all reflections included in the refinement	0.104
Goodness-of-fit parameter for all reflections included in the refinement	1.069
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
228491 (current)	2019-11-17	cif/ Updating files of 7121756, 7121757, 7121758, 7121759, 7121760 Original log message: Adding full bibliography for 7121756--7121760.cif.	7121757.cif
207972	2018-05-25	cif/ Adding structures of 7121756, 7121757, 7121758, 7121759, 7121760 via cif-deposit CGI script.	7121757.cif