Crystallography Open Database

Information card for entry 1567999

Preview

Coordinates	1567999.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H30 Cu3 N6 Na O4 S6
Calculated formula	C20 H30 Cu3 N6 Na O4 S6
Title of publication	Experimental assignment of long-range magnetic communication through Pd & Pt metallophilic contacts.
Authors of publication	Larsen, Emil M. H.; Bonde, Niels A.; Weihe, Høgni; Ollivier, Jacques; Vosch, Tom; Lohmiller, Thomas; Holldack, Karsten; Schnegg, Alexander; Perfetti, Mauro; Bendix, Jesper
Journal of publication	Chemical science
Year of publication	2023
Journal volume	14
Journal issue	2
Pages of publication	266 - 276
a	19.568 ± 0.004 Å
b	10.61 ± 0.004 Å
c	30.314 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	6294 ± 3 Å³
Cell temperature	213 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	64
Hermann-Mauguin space group symbol	C m c e
Hall space group symbol	-C 2ac 2
Residual factor for all reflections	0.0416
Residual factor for significantly intense reflections	0.0318
Weighted residual factors for significantly intense reflections	0.0722
Weighted residual factors for all reflections included in the refinement	0.0747
Goodness-of-fit parameter for all reflections included in the refinement	1.443
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
283159 (current)	2023-05-05	cif/ Updating files of 1567999, 1568000, 1568001, 1568002, 1568003, 1568004 Original log message: Adding full bibliography for 1567999--1568004.cif.	1567999.cif
279477	2022-11-23	cif/ Adding structures of 1567999, 1568000, 1568001, 1568002, 1568003, 1568004 via cif-deposit CGI script.	1567999.cif