Crystallography Open Database

Information card for entry 7130345

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Coordinates	7130345.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C206 H182 N14 O68 Rh12
Calculated formula	C206 H180 N14 O68 Rh12
Title of publication	Synthesis of the Two Isomers of Heteroleptic Rh12L6L’6 Metal-Organic Polyhedra by Screening of Complementary Linkers
Authors of publication	Broto-Ribas, Anna; Gutiérrez, Susana; Imaz, Inhar; Carné-Sánchez, Arnau; Gándara, Felipe; Juanhuix, Judith; Maspoch, Daniel
Journal of publication	Chemical Communications
Year of publication	2022
a	20.10034 ± 0.00007 Å
b	21.47025 ± 0.00006 Å
c	23.37885 ± 0.00008 Å
α	99.5536 ± 0.0003°
β	109.206 ± 0.0003°
γ	113.948 ± 0.0007°
Cell volume	8166.47 ± 0.08 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0823
Residual factor for significantly intense reflections	0.0796
Weighted residual factors for significantly intense reflections	0.2431
Weighted residual factors for all reflections included in the refinement	0.2478
Goodness-of-fit parameter for all reflections included in the refinement	1.043
Diffraction radiation wavelength	0.82656 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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