Crystallography Open Database

Information card for entry 7715723

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Coordinates	7715723.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C84 H76 Co12 O60 P6
Calculated formula	C84 H76.0004 Co12 O60 P6
Title of publication	Discovery of two predictable (3, 18)-connected topologies based on Wells-Dawson type cage for the design of porous metal phosphonocarboxylate frameworks
Authors of publication	Dan, Wenyan; Chen, Zhenxia; Ling, Yun; Jia, Yu; Yang, Yongtai; Liu, Xiaofeng; Deng, Mingli
Journal of publication	Dalton Transactions
Year of publication	2024
a	17.07 ± 0.005 Å
b	17.07 ± 0.005 Å
c	39.806 ± 0.011 Å
α	90°
β	90°
γ	120°
Cell volume	10045 ± 5 Å³
Cell temperature	296.15 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	5
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.1889
Residual factor for significantly intense reflections	0.1053
Weighted residual factors for significantly intense reflections	0.2877
Weighted residual factors for all reflections included in the refinement	0.346
Goodness-of-fit parameter for all reflections included in the refinement	1.161
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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