Crystallography Open Database

Information card for entry 7716180

Preview

Coordinates	7716180.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C80 H73 Ag Al F46 Fe Ni2 O3 P5
Calculated formula	C80 H73 Ag Al F46 Fe Ni2 O3 P5
Title of publication	Homo- and heterobimetallic transition metal cluster derived from [Cp*Fe(η<sup>5</sup>-E<sub>5</sub>)] (E = P, As) - unprecedented structural motifs of the resulting polypnictogen ligands.
Authors of publication	Dinauer, Sabrina B.; Szlosek, Robert; Piesch, Martin; Balázs, Gábor; Reichl, Stephan; Prock, Lukas; Riesinger, Christoph; Walter, Marc D.; Scheer, Manfred
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	24
Pages of publication	10201 - 10207
a	14.914 ± 0.0006 Å
b	19.2206 ± 0.0009 Å
c	19.5632 ± 0.0009 Å
α	63.886 ± 0.004°
β	79.623 ± 0.004°
γ	72.65 ± 0.004°
Cell volume	4798.5 ± 0.4 Å³
Cell temperature	122.98 ± 0.1 K
Ambient diffraction temperature	122.98 ± 0.1 K
Number of distinct elements	9
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0314
Residual factor for significantly intense reflections	0.0254
Weighted residual factors for significantly intense reflections	0.0583
Weighted residual factors for all reflections included in the refinement	0.0593
Goodness-of-fit parameter for all reflections included in the refinement	0.902
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

Version history

Revision	Date	Message	Files
293001 (current)	2024-07-05	cif/ Updating files of 7716174, 7716175, 7716176, 7716177, 7716178, 7716179, 7716180 Original log message: Adding full bibliography for 7716174--7716180.cif.	7716180.cif
292059	2024-05-28	cif/ Adding structures of 7716174, 7716175, 7716176, 7716177, 7716178, 7716179, 7716180 via cif-deposit CGI script.	7716180.cif