Crystallography Open Database

Information card for entry 7703838

Preview

Coordinates	7703838.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C57 H46 B Cl2 F24 Rh S2 Si
Calculated formula	C57 H46 B Cl2 F24 Rh S2 Si
Title of publication	Si-C(sp<sup>3</sup>) bond activation through oxidative addition at a Rh(i) centre.
Authors of publication	Azpeitia, S.; Martínez-Martínez, A J; Garralda, M. A.; Weller, A. S.; Huertos, M. A.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	17
Pages of publication	5416 - 5419
a	12.4418 ± 0.0003 Å
b	12.9564 ± 0.0003 Å
c	20.2172 ± 0.0006 Å
α	99.872 ± 0.002°
β	101.171 ± 0.002°
γ	97.292 ± 0.002°
Cell volume	3106.4 ± 0.14 Å³
Cell temperature	150 ± 0.16 K
Ambient diffraction temperature	150 ± 0.16 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0532
Residual factor for significantly intense reflections	0.0464
Weighted residual factors for significantly intense reflections	0.1202
Weighted residual factors for all reflections included in the refinement	0.1265
Goodness-of-fit parameter for all reflections included in the refinement	1.02
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
252754 (current)	2020-06-05	cif/ Updating files of 7703836, 7703837, 7703838, 7703839 Original log message: Adding full bibliography for 7703836--7703839.cif.	7703838.cif
249647	2020-03-24	cif/ Adding structures of 7703836, 7703837, 7703838, 7703839 via cif-deposit CGI script.	7703838.cif