Crystallography Open Database

Information card for entry 7061602

Preview

Coordinates	7061602.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H20.67 F13 N5 O1.33 P2 Ru
Calculated formula	C20 H20.6667 F13 N5 O1.33333 P2 Ru
Title of publication	The influence of the trans-ligand to NO on the thermal stability of the photoinduced side-bond coordinated linkage isomer
Authors of publication	Mikhailov, Artem A.; Kostin, Gennadiy A.; Schaniel, Dominik
Journal of publication	New Journal of Chemistry
Year of publication	2022
Journal volume	46
Journal issue	26
Pages of publication	12641 - 12650
a	13.9264 ± 0.0005 Å
b	16.948 ± 0.0007 Å
c	19.8185 ± 0.0008 Å
α	66.776 ± 0.001°
β	79.868 ± 0.002°
γ	84.674 ± 0.001°
Cell volume	4230.2 ± 0.3 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 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	0.0992
Residual factor for significantly intense reflections	0.0813
Weighted residual factors for significantly intense reflections	0.1596
Weighted residual factors for all reflections included in the refinement	0.1661
Goodness-of-fit parameter for all reflections included in the refinement	1.2
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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