Crystallography Open Database

Information card for entry 7130343

Preview

Coordinates	7130343.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C195 H115 N19 O67 Rh12
Calculated formula	C195 H115 N19 O67 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	22.9616 ± 0.0005 Å
b	27.9645 ± 0.0004 Å
c	29.9154 ± 0.0004 Å
α	87.892 ± 0.002°
β	68.779 ± 0.002°
γ	77.069 ± 0.002°
Cell volume	17431.6 ± 0.6 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	0.1379
Residual factor for significantly intense reflections	0.1123
Weighted residual factors for significantly intense reflections	0.3103
Weighted residual factors for all reflections included in the refinement	0.3414
Goodness-of-fit parameter for all reflections included in the refinement	1.17
Diffraction radiation wavelength	0.82656 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
276785 (current)	2022-07-23	cif/ Adding structures of 7130335, 7130336, 7130337, 7130338, 7130339, 7130340, 7130341, 7130342, 7130343, 7130344, 7130345, 7130346 via cif-deposit CGI script.	7130343.cif