Crystallography Open Database

Information card for entry 7035051

Preview

Coordinates	7035051.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C90 H137 N7 O12 S4 W2
Calculated formula	C90 H137 N7 O12 S4 W2
Title of publication	Aminobisphenolate supported tungsten disulphido and dithiolene complexes.
Authors of publication	Salojärvi, E; Peuronen, A.; Sillanpää, R; Damlin, P.; Kivelä, H; Lehtonen, A.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	20
Pages of publication	9409 - 9416
a	16.18664 ± 0.00009 Å
b	34.93266 ± 0.00018 Å
c	18.54984 ± 0.0001 Å
α	90°
β	113.685 ± 0.0006°
γ	90°
Cell volume	9605.34 ± 0.1 Å³
Cell temperature	123.01 ± 0.1 K
Ambient diffraction temperature	123.01 ± 0.1 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	0.0254
Residual factor for significantly intense reflections	0.0233
Weighted residual factors for significantly intense reflections	0.0552
Weighted residual factors for all reflections included in the refinement	0.0563
Goodness-of-fit parameter for all reflections included in the refinement	1.035
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
138675 (current)	2015-06-07	cif/ Updating files of 7035048, 7035049, 7035050, 7035051, 7035052 Original log message: Adding full bibliography for 7035048--7035052.cif.	7035051.cif
135927	2015-05-09	cif/ Adding structures of 7035048, 7035049, 7035050, 7035051, 7035052 via cif-deposit CGI script.	7035051.cif