Crystallography Open Database

Information card for entry 4122764

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Coordinates	4122764.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C156 H180 Ag6 Cl24 F36 N24 O6 P6 S6
Calculated formula	C144 H156 Ag6 F35.96 N24 O6 P6 S6
Title of publication	Porous molecular crystals by macrocyclic coordination supramolecules.
Authors of publication	Bassanetti, Irene; Comotti, Angiolina; Sozzani, Piero; Bracco, Silvia; Calestani, Gianluca; Mezzadri, Francesco; Marchiò, Luciano
Journal of publication	Journal of the American Chemical Society
Year of publication	2014
Journal volume	136
Journal issue	42
Pages of publication	14883 - 14895
a	42.95 ± 0.003 Å
b	42.95 ± 0.003 Å
c	42.95 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	79230 ± 10 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	9
Space group number	203
Hermann-Mauguin space group symbol	F d -3 :2
Hall space group symbol	-F 2uv 2vw 3
Residual factor for all reflections	0.1093
Residual factor for significantly intense reflections	0.0773
Weighted residual factors for significantly intense reflections	0.2156
Weighted residual factors for all reflections included in the refinement	0.2453
Goodness-of-fit parameter for all reflections included in the refinement	1.087
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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