Crystallography Open Database

Information card for entry 7053341

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Coordinates	7053341.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C78 H70 N4 O12 Tb2
Calculated formula	C78 H70 N4 O12 Tb2
Title of publication	Crystal structures, luminescent and thermal properties of a new series of lanthanide complexes with 4-ethylbenzoic acid
Authors of publication	Ye, Hong-Mei; Ren, Ning; Zhang, Jian-Jun; Sun, Shu-Jing; Wang, Juan-Fen
Journal of publication	New Journal of Chemistry
Year of publication	2010
Journal volume	34
Journal issue	3
Pages of publication	533
a	12.0849 ± 0.0013 Å
b	15.7273 ± 0.0018 Å
c	18.7487 ± 0.0019 Å
α	77.978 ± 0.003°
β	74.991 ± 0.003°
γ	87.569 ± 0.003°
Cell volume	3366.1 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.0453
Residual factor for significantly intense reflections	0.0371
Weighted residual factors for significantly intense reflections	0.0837
Weighted residual factors for all reflections included in the refinement	0.0895
Goodness-of-fit parameter for all reflections included in the refinement	1.001
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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