Crystallography Open Database

Information card for entry 7703721

Preview

Coordinates	7703721.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C99 H110 Cl6 Mn6 N6 Na2 O27 Tb
Calculated formula	C99 H93 Cl6 Mn6 N6 Na2 O26.9998 Tb
Title of publication	Na<sub>2</sub>MnLn<sup>III</sup> clusters with a non-equivalent core: chiral vs. meso isomerism.
Authors of publication	Mayans, Júlia; Font-Bardia, Mercè; Escuer, Albert
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	14
Pages of publication	4216 - 4219
a	19.424 ± 0.0008 Å
b	19.424 ± 0.0008 Å
c	28.5924 ± 0.001 Å
α	90°
β	90°
γ	120°
Cell volume	9342.4 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0673
Residual factor for significantly intense reflections	0.0465
Weighted residual factors for significantly intense reflections	0.1229
Weighted residual factors for all reflections included in the refinement	0.1269
Goodness-of-fit parameter for all reflections included in the refinement	0.946
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
251641 (current)	2020-05-05	cif/ Updating files of 7703720, 7703721, 7703722, 7703723, 7703724, 7703725 Original log message: Adding full bibliography for 7703720--7703725.cif.	7703721.cif
249260	2020-03-11	cif/ Adding structures of 7703720, 7703721, 7703722, 7703723, 7703724, 7703725 via cif-deposit CGI script.	7703721.cif