Crystallography Open Database

Information card for entry 7717232

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Coordinates	7717232.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H57 Cl3 N6 P2
Calculated formula	C45 H57 Cl3 N6 P2
Title of publication	Ruthenium, copper and ruthenium-copper complexes of an unsymmetrical phosphino pyridyl 1,8-naphthyridine PNNN ligand
Authors of publication	Wu, Jingyun; Stevens, Michael Andrew; Gardiner, Michael; Colebatch, Annie Louise
Journal of publication	Dalton Transactions
Year of publication	2024
a	18.4963 ± 0.0002 Å
b	6.1795 ± 0.0001 Å
c	20.5648 ± 0.0003 Å
α	90°
β	107.98 ± 0.001°
γ	90°
Cell volume	2235.72 ± 0.06 Å³
Cell temperature	150.01 ± 0.1 K
Ambient diffraction temperature	150.01 ± 0.1 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0389
Residual factor for significantly intense reflections	0.0358
Weighted residual factors for significantly intense reflections	0.0913
Weighted residual factors for all reflections included in the refinement	0.0934
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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