Crystallography Open Database

Information card for entry 7064170

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Coordinates	7064170.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H25 N5 O6 Ru
Calculated formula	C19 H25 N5 O6 Ru
Title of publication	Unlocking reactivity: synthetic, structural and catalytic exploration of ruthenium(II) complexes featuring pdc and NHC ligands
Authors of publication	Awe, Babatunde; Swart, Glendin; Erasmus, Elizabeth; Landman, Marilé; Malan, Frederick Pieter
Journal of publication	New Journal of Chemistry
Year of publication	2026
a	8.2408 ± 0.0002 Å
b	10.3384 ± 0.0003 Å
c	14.7449 ± 0.0004 Å
α	109.197 ± 0.002°
β	91.635 ± 0.002°
γ	112.158 ± 0.002°
Cell volume	1081.91 ± 0.06 Å³
Cell temperature	149.99 ± 0.1 K
Ambient diffraction temperature	149.99 ± 0.1 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0379
Residual factor for significantly intense reflections	0.0322
Weighted residual factors for significantly intense reflections	0.0778
Weighted residual factors for all reflections included in the refinement	0.0804
Goodness-of-fit parameter for all reflections included in the refinement	1.061
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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