Crystallography Open Database

Information card for entry 1570981

Preview

Coordinates	1570981.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C61 H32 B F24 N7 Pt2
Calculated formula	C61 H32 B F24 N7 Pt2
Title of publication	Cyanido-bridged diplatinum(ii) complexes: ligand and solvent effect on aggregation and luminescence.
Authors of publication	Khistiaeva, Viktoria V.; Buss, Stefan; Eskelinen, Toni; Hirva, Pipsa; Kinnunen, Niko; Friedel, Joshua; Kletsch, Lukas; Klein, Axel; Strassert, Cristian A.; Koshevoy, Igor O.
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	11
Pages of publication	4005 - 4018
a	37.583 ± 0.004 Å
b	19.55 ± 0.002 Å
c	16.6042 ± 0.0019 Å
α	90°
β	103.385 ± 0.002°
γ	90°
Cell volume	11869 ± 2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.115
Residual factor for significantly intense reflections	0.0817
Weighted residual factors for significantly intense reflections	0.187
Weighted residual factors for all reflections included in the refinement	0.2085
Goodness-of-fit parameter for all reflections included in the refinement	1.045
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
290851 (current)	2024-04-05	cif/ Updating files of 1570980, 1570981, 1570982, 1570983 Original log message: Adding full bibliography for 1570980--1570983.cif.	1570981.cif
289793	2024-02-13	cif/ Adding structures of 1570980, 1570981, 1570982, 1570983 via cif-deposit CGI script.	1570981.cif