Crystallography Open Database

Information card for entry 7039978

Preview

Coordinates	7039978.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C59 H26 As5 Cl6 Cr4 F24 Hg6
Calculated formula	C59 H26 As5 Cl6 Cr4 F24 Hg6
Title of publication	Supramolecular adducts based on weak interactions between the trimeric Lewis acid complex (perfluoro-ortho-phenylene)mercury and polypnictogen complexes.
Authors of publication	Fleischmann, Martin; Jones, James S.; Balázs, Gábor; Gabbaï, François P; Scheer, Manfred
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	35
Pages of publication	13742 - 13749
a	19.1852 ± 0.0001 Å
b	19.7869 ± 0.0001 Å
c	18.7288 ± 0.0001 Å
α	90°
β	99.054 ± 0.001°
γ	90°
Cell volume	7021.16 ± 0.07 Å³
Cell temperature	123 ± 0.14 K
Ambient diffraction temperature	123 ± 0.14 K
Number of distinct elements	7
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	0.0284
Residual factor for significantly intense reflections	0.0254
Weighted residual factors for significantly intense reflections	0.0578
Weighted residual factors for all reflections included in the refinement	0.0588
Goodness-of-fit parameter for all reflections included in the refinement	1.031
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
186379 (current)	2016-09-10	cif/ Updating files of 7039972, 7039973, 7039974, 7039975, 7039976, 7039977, 7039978, 7039979, 7039980, 7039981 Original log message: Adding full bibliography for 7039972--7039981.cif.	7039978.cif
184575	2016-07-21	cif/ Adding structures of 7039972, 7039973, 7039974, 7039975, 7039976, 7039977, 7039978, 7039979, 7039980, 7039981 via cif-deposit CGI script.	7039978.cif