Crystallography Open Database

Information card for entry 4502473

Preview

Coordinates	4502473.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C58 H46 Br4 Cl5 N8 O12 Tb3
Calculated formula	C58 H46 Br4 Cl5 N8 O12 Tb3
Title of publication	Transformation of a Luminescent Benzimidazole-Based Yb3Cluster into a One-Dimensional Coordination Polymer
Authors of publication	Yang, Xiaoping; Jones, Richard A.; Wiester, Michael J.; Oye, Michael M.; Wong, Wai-Kwok
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	2
Pages of publication	970
a	25.992 ± 0.004 Å
b	25.992 ± 0.004 Å
c	23.403 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	15811 ± 5 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	7
Space group number	130
Hermann-Mauguin space group symbol	P 4/n c c :2
Hall space group symbol	-P 4a 2ac
Residual factor for all reflections	0.1879
Residual factor for significantly intense reflections	0.0962
Weighted residual factors for significantly intense reflections	0.2024
Weighted residual factors for all reflections included in the refinement	0.2334
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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