Crystallography Open Database

Information card for entry 7059046

Preview

Coordinates	7059046.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H20 Cl2 F N5 O9 Ru
Calculated formula	C20 H20 Cl2 F N5 O9 Ru
Title of publication	High thermal stability of the Ru‒ON (MS1) linkage isomer of the ruthenium nitrosyl complex [RuNO(Py)4F](ClO4)2 with the trans NO‒Ru‒F coordinate
Authors of publication	Kostin, Gennadiy A.; Mikhailov, Artem A.; Kuratieva, Natalia V.; Pishchur, Denis P.; Makhinya, Alexander N.
Journal of publication	New Journal of Chemistry
Year of publication	2018
Journal volume	42
Journal issue	23
Pages of publication	18928
a	10.442 ± 0.001 Å
b	16.4514 ± 0.0017 Å
c	16.4752 ± 0.0019 Å
α	65.968 ± 0.003°
β	82.841 ± 0.003°
γ	87.442 ± 0.003°
Cell volume	2564.7 ± 0.5 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0419
Residual factor for significantly intense reflections	0.0321
Weighted residual factors for significantly intense reflections	0.0749
Weighted residual factors for all reflections included in the refinement	0.0782
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
227890 (current)	2019-11-15	cif/ Adding structures of 7059046 via cif-deposit CGI script.	7059046.cif