Crystallography Open Database

Information card for entry 1568313

Preview

Coordinates	1568313.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C111.65 H163.3 B4 Cl3.3 F6 Ge2 N8 O6 P2 S2
Calculated formula	C110.65 H161.3 B4 Cl1.3 F6 Ge2 N8 O6 P2 S2
Title of publication	A convenient route to mixed cationic group 13/14/15 compounds
Authors of publication	Ackermann, Matthias T.; Seidl, Michael; Grande, Riccardo; Zhou, Yuqiao; Ferguson, Michael J.; Timoshkin, Alexey Y.; Rivard, Eric; Scheer, Manfred
Journal of publication	Chemical Science
Year of publication	2023
Journal volume	14
Journal issue	9
Pages of publication	2313 - 2317
a	35.1849 ± 0.0003 Å
b	10.4401 ± 0.0001 Å
c	35.7996 ± 0.0003 Å
α	90°
β	105.925 ± 0.001°
γ	90°
Cell volume	12645.7 ± 0.2 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	10
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	0.1081
Residual factor for significantly intense reflections	0.0762
Weighted residual factors for significantly intense reflections	0.1957
Weighted residual factors for all reflections included in the refinement	0.2096
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
281383 (current)	2023-03-04	cif/ Updating files of 1568311, 1568312, 1568313, 1568314 Original log message: Adding full bibliography for 1568311--1568314.cif.	1568313.cif
280475	2023-01-21	cif/ Adding structures of 1568311, 1568312, 1568313, 1568314 via cif-deposit CGI script.	1568313.cif