Crystallography Open Database

Information card for entry 7018940

Preview

Coordinates	7018940.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C55 H44 Cl5 P3 Pd3 S3
Calculated formula	C54.996 H43.992 Cl4.992 P3 Pd3 S3
Title of publication	Reaction of a heterotopic P,SAs ligand with group 10 metal(ii) complexes: As-S bond cleavage and the formation of two unusual trinuclear structural isomers for Pd and Pt.
Authors of publication	Sárosi, Imola; Hildebrand, Alexandra; Lönnecke, Peter; Silaghi-Dumitrescu, Luminiţa; Hey-Hawkins, Evamarie
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	17
Pages of publication	5326 - 5333
a	19.6305 ± 0.0002 Å
b	11.4076 ± 0.0001 Å
c	23.9533 ± 0.0002 Å
α	90°
β	96.739 ± 0.001°
γ	90°
Cell volume	5326.97 ± 0.09 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	6
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	0.0561
Residual factor for significantly intense reflections	0.0303
Weighted residual factors for significantly intense reflections	0.0486
Weighted residual factors for all reflections included in the refinement	0.0511
Goodness-of-fit parameter for all reflections included in the refinement	0.809
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
179893 (current)	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/89.	7018940.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7018940.cif
56002	2012-05-08	cif/ Adding structures of 7018939, 7018940, 7018941, 7018942, 7018943 via cif-deposit CGI script.	7018940.cif