Crystallography Open Database

Information card for entry 7719456

7719455 << 7719456 >> 7719457

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Coordinates	7719456.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H55 B F24 N4 O5 P Ru
Calculated formula	C52 H39 B F24 N4 O3 P Ru
Title of publication	On the chemistry of <i>p</i>-cymene ruthenium iodide complexes: entry into octahedral phenylated ruthenium(II) complexes supported by chelating bidentate N,N'-donor ligands.
Authors of publication	Quillian, Brandon; Marks, Allison; Musso, Kennedy; Durrell, George; Bazemore, Joseph; Padgett, Clifford W.; Fields, Alexis; Zurwell, Dane
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
a	14.026 ± 0.003 Å
b	14.2764 ± 0.0018 Å
c	34.33 ± 0.013 Å
α	90°
β	93.04 ± 0.03°
γ	90°
Cell volume	6865 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
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	0.2413
Residual factor for significantly intense reflections	0.1278
Weighted residual factors for significantly intense reflections	0.3208
Weighted residual factors for all reflections included in the refinement	0.4115
Goodness-of-fit parameter for all reflections included in the refinement	0.942
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
302118 (current)	2025-09-12	cif/ Adding structures of 7719452, 7719453, 7719454, 7719455, 7719456, 7719457 via cif-deposit CGI script.	7719456.cif