Crystallography Open Database

Information card for entry 7109523

Preview

Coordinates	7109523.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C77 H104 N16 O7 S10 Sn6
Calculated formula	C77 H104 N16 O7 S10 Sn6
Title of publication	Towards the installation of transition metal ions on donor ligand decorated tin sulfide clusters
Authors of publication	Beatrix E. K. Barth; Eliza Leusmann; Klaus Harms; Stefanie Dehnen
Journal of publication	Chem.Commun.
Year of publication	2013
Journal volume	49
Pages of publication	6590
a	13.0812 ± 0.0011 Å
b	22.5874 ± 0.0014 Å
c	16.9755 ± 0.0013 Å
α	90°
β	96.153 ± 0.006°
γ	90°
Cell volume	4986.9 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.1115
Residual factor for significantly intense reflections	0.0463
Weighted residual factors for significantly intense reflections	0.0718
Weighted residual factors for all reflections included in the refinement	0.0855
Goodness-of-fit parameter for all reflections included in the refinement	0.821
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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