Crystallography Open Database

Information card for entry 2023379

2023378 << 2023379 >> 2023380

Preview

Coordinates	2023379.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	(Bromoselanyl)di-<i>tert</i>-butylisopropylphosphanium di-μ-bromido-bis[dibromidopalladium(II)]
Formula	C22 H50 Br8 P2 Pd2 Se2
Calculated formula	C22 H50 Br8 P2 Pd2 Se2
Title of publication	Crystal structures of six complexes of phosphane chalcogenides R 1 R 2 R 3PE (R = tert-butyl or isopropyl, E = S or Se) with the metal halides MX 2 (M = Pd or Pt, X = Cl or Br), two halochalcogenylphosphonium derivatives ( t Bu2 iPrPEBr)2[Pd2Br6] and one hydrolysis product
Authors of publication	Upmann, Daniel; Jones, Peter G.
Journal of publication	Acta Crystallographica Section E Crystallographic Communications
Year of publication	2025
Journal volume	81
Journal issue	3
a	19.355 ± 0.0006 Å
b	14.8165 ± 0.0002 Å
c	16.3047 ± 0.0005 Å
α	90°
β	125.957 ± 0.005°
γ	90°
Cell volume	3784.8 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0507
Residual factor for significantly intense reflections	0.0312
Weighted residual factors for significantly intense reflections	0.0521
Weighted residual factors for all reflections included in the refinement	0.0565
Goodness-of-fit parameter for all reflections included in the refinement	1.037
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
297594 (current)	2025-02-05	cif/ Adding structures of 2023372, 2023373, 2023374, 2023375, 2023376, 2023377, 2023378, 2023379, 2023380 via cif-deposit CGI script.	2023379.cif