Crystallography Open Database

Information card for entry 7718342

Preview

Coordinates	7718342.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	tris(4-methoxybenzoylacetonato)iron(III)
Formula	C33 H33 Fe O9
Calculated formula	C33 H33 Fe O9
Title of publication	Complete ligand substitution and oxidation of the metal center in the photochemical reaction of CpM(CO)<sub>2</sub>I (M = Fe, Ru) with chelating β-diketones.
Authors of publication	Jarzyński, Szymon; Doroszko, Cyprian; Jamroz, Daria; Stefanowska-Kątna, Kinga; Walkowiak, Jędrzej; Wojtulewski, Sławomir; Zakrzewski, Janusz; Rudolf, Bogna
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	14
Pages of publication	5935 - 5943
a	14.2832 ± 0.0007 Å
b	15.678 ± 0.0008 Å
c	13.2979 ± 0.0005 Å
α	90°
β	97.346 ± 0.004°
γ	90°
Cell volume	2953.4 ± 0.2 Å³
Cell temperature	100 ± 1 K
Ambient diffraction temperature	100 ± 1 K
Number of distinct elements	4
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	0.085
Residual factor for significantly intense reflections	0.0668
Weighted residual factors for significantly intense reflections	0.1732
Weighted residual factors for all reflections included in the refinement	0.1857
Goodness-of-fit parameter for all reflections included in the refinement	1.086
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

Version history

Revision	Date	Message	Files
300892 (current)	2025-07-06	cif/ Updating files of 7718342 Original log message: Adding full bibliography for 7718342.cif.	7718342.cif
298483	2025-03-18	cif/ Adding structures of 7718342 via cif-deposit CGI script.	7718342.cif