Crystallography Open Database

Information card for entry 7130340

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Coordinates	7130340.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	het-Rh-MOP-1
Formula	C186 H150 N18 O54 Rh12
Calculated formula	C186 H150 N18 O54 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	31.163 Å
b	31.163 Å
c	69.154 Å
α	90°
β	90°
γ	120°
Cell volume	58160.3 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	5
Space group number	167
Hermann-Mauguin space group symbol	R -3 c :H
Hall space group symbol	-R 3 2"c
Residual factor for all reflections	0.1108
Residual factor for significantly intense reflections	0.1002
Weighted residual factors for significantly intense reflections	0.3216
Weighted residual factors for all reflections included in the refinement	0.3418
Goodness-of-fit parameter for all reflections included in the refinement	1.366
Diffraction radiation wavelength	0.82656 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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