Crystallography Open Database

Information card for entry 1562247

Preview

Coordinates	1562247.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11 H33 Cl2 N2 O16 Pr
Calculated formula	C11 H31 Cl2 N2 O16 Pr
Title of publication	Acidic 1,3-propanediaminetetraacetato lanthanides with luminescent and catalytic ester hydrolysis properties
Authors of publication	Chen, Mao-Long; Shi, Yan-Ru; Yang, Yu-Chen; Zhou, Zhao-Hui
Journal of publication	Journal of Solid State Chemistry
Year of publication	2014
Journal volume	219
Pages of publication	265 - 273
a	10.0547 ± 0.0005 Å
b	23.4124 ± 0.0011 Å
c	10.088 ± 0.0005 Å
α	90°
β	91.386 ± 0.004°
γ	90°
Cell volume	2374.1 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173.15 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0754
Residual factor for significantly intense reflections	0.0575
Weighted residual factors for significantly intense reflections	0.1076
Weighted residual factors for all reflections included in the refinement	0.1143
Goodness-of-fit parameter for all reflections included in the refinement	1.17
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
264686 (current)	2021-04-29	cif/ Adding structures of 1562245, 1562246, 1562247, 1562248, 1562249, 1562250, 1562251, 1562252, 1562253, 1562254, 1562255, 1562256, 1562257, 1562258, 1562259, 1562260, 1562261, 1562262, 1562263, 1562264 via cif-deposit CGI script.	1562247.cif