Test Crystallography Open Database

Information card for entry 4300002

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Coordinates	4300002.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C3 H18 Cl N O13 P3 Pr
Calculated formula	C3 H14 Cl N O13 P3 Pr
Title of publication	Luminescent and Proton Conducting Lanthanide Coordination Networks Based On a Zwitterionic Tripodal Triphosphonate
Authors of publication	Bazaga-García, Montse; Angeli, Giasemi K.; Papathanasiou, Konstantinos E.; Salcedo, Inés R.; Olivera-Pastor, Pascual; Losilla, Enrique R.; Choquesillo-Lazarte, Duane; Hix, Gary B.; Cabeza, Aurelio; Demadis, Konstantinos D.
Journal of publication	Inorganic Chemistry
Year of publication	2016
Journal volume	55
Journal issue	15
Pages of publication	7414 - 7424
a	11.2998 ± 0.0008 Å
b	17.7086 ± 0.0012 Å
c	8.6894 ± 0.0006 Å
α	90°
β	115.83 ± 0.002°
γ	90°
Cell volume	1565.06 ± 0.19 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0596
Residual factor for significantly intense reflections	0.0594
Weighted residual factors for significantly intense reflections	0.1593
Weighted residual factors for all reflections included in the refinement	0.1596
Goodness-of-fit parameter for all reflections included in the refinement	1.098
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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