Crystallography Open Database

Information card for entry 7061601

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Coordinates	7061601.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H49 F26 N13 O2 P4 Ru2
Calculated formula	C46 H49 F26 N13 O2 P4 Ru2
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	20.7752 ± 0.0013 Å
b	15.3676 ± 0.0009 Å
c	19.9513 ± 0.0009 Å
α	90°
β	99.0464 ± 0.0015°
γ	90°
Cell volume	6290.5 ± 0.6 Å³
Cell temperature	150 ± 1 K
Ambient diffraction temperature	150 ± 1 K
Number of distinct elements	7
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	0.0928
Residual factor for significantly intense reflections	0.0579
Weighted residual factors for significantly intense reflections	0.1342
Weighted residual factors for all reflections included in the refinement	0.1576
Goodness-of-fit parameter for all reflections included in the refinement	1.016
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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