Crystallography Open Database

Information card for entry 7040028

Preview

Coordinates	7040028.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C156.5 H215 F13.5 N13.5 O53 Rh9 S4.5
Calculated formula	C142 H159 F9 N13.5 O35.5 Rh9 S3
Title of publication	A nonanuclear triangular macrocycle and a linear heptanuclear heterometallic complex based on a 2-substituted imidazole-4,5-dicarboxylate ligand.
Authors of publication	Lin, Yue-Jian; Shan, Wei-Long; Jin, Guo-Xin
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	32
Pages of publication	12680 - 12684
a	16.272 ± 0.0008 Å
b	23.9463 ± 0.0011 Å
c	26.2849 ± 0.0012 Å
α	90.727 ± 0.002°
β	91.725 ± 0.002°
γ	107.527 ± 0.002°
Cell volume	9759.6 ± 0.8 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1189
Residual factor for significantly intense reflections	0.0951
Weighted residual factors for significantly intense reflections	0.2675
Weighted residual factors for all reflections included in the refinement	0.2913
Goodness-of-fit parameter for all reflections included in the refinement	1.092
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
186432 (current)	2016-09-10	cif/ Updating files of 7040026, 7040027, 7040028 Original log message: Adding full bibliography for 7040026--7040028.cif.	7040028.cif
184634	2016-07-23	cif/ Adding structures of 7040026, 7040027, 7040028 via cif-deposit CGI script.	7040028.cif