Crystallography Open Database

Information card for entry 7107554

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Coordinates	7107554.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C218 H276 Ag6 F18 N24 O18 P12 S2
Calculated formula	C216 H275.97 Ag6 F12 N24 O12 P12 S4
Title of publication	Selective formation of a polar incomplete coordination cage induced by remote ligand substituents
Authors of publication	Nicola Giri; William Clegg; Ross W. Harrington; Peter N. Horton; Michael B. Hursthouse; Stuart L. James
Journal of publication	Chem.Commun.
Year of publication	2012
Journal volume	48
Pages of publication	4061
a	26.8708 ± 0.0008 Å
b	26.8708 ± 0.0008 Å
c	51.831 ± 0.003 Å
α	90°
β	90°
γ	120°
Cell volume	32410 ± 2 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	8
Space group number	159
Hermann-Mauguin space group symbol	P 3 1 c
Hall space group symbol	P 3 -2c
Residual factor for all reflections	0.0706
Residual factor for significantly intense reflections	0.0644
Weighted residual factors for significantly intense reflections	0.1821
Weighted residual factors for all reflections included in the refinement	0.1913
Goodness-of-fit parameter for all reflections included in the refinement	1.045
Diffraction radiation wavelength	0.6926 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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