Crystallography Open Database

Information card for entry 4122766

Preview

Coordinates	4122766.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H64 Ag2 F6 N8 O7.5 S4
Calculated formula	C56 H64 Ag2 F6 N8 O7.5 S4
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	30.542 ± 0.007 Å
b	22.961 ± 0.005 Å
c	24.166 ± 0.005 Å
α	90°
β	131.839 ± 0.003°
γ	90°
Cell volume	12626 ± 5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1265
Residual factor for significantly intense reflections	0.0532
Weighted residual factors for significantly intense reflections	0.1217
Weighted residual factors for all reflections included in the refinement	0.1488
Goodness-of-fit parameter for all reflections included in the refinement	1.015
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4122766.html