Crystallography Open Database

Information card for entry 7114050

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Coordinates	7114050.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C309 H269 Ag6 Cl3 N6 O26 P12
Calculated formula	C308.99 H252.96 Ag6 Cl2.97 N6 O25.99 P12
Title of publication	Assembly of a coordination cage with four aromatic channel receptors on the outside
Authors of publication	Miller, Philip W.; Nieuwenhuyzen, Mark; Xu, Xingling; James, Stuart L.
Journal of publication	Chemical Communications
Year of publication	2002
Journal issue	18
Pages of publication	2008
a	30.7586 ± 0.001 Å
b	30.7586 ± 0.001 Å
c	30.7586 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	29100.4 ± 1.6 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	7
Space group number	198
Hermann-Mauguin space group symbol	P 21 3
Hall space group symbol	P 2ac 2ab 3
Residual factor for all reflections	0.187
Residual factor for significantly intense reflections	0.1141
Weighted residual factors for significantly intense reflections	0.2861
Weighted residual factors for all reflections included in the refinement	0.3296
Goodness-of-fit parameter for all reflections included in the refinement	1.37
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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