Crystallography Open Database

Information card for entry 1561559

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Coordinates	1561559.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11 H30 N2 O16 Pb2
Calculated formula	C11 H30 N2 O16 Pb2
Title of publication	Transformations of lead 1,3-propylenediaminetetraacetate to its MOF products for the selective adsorption of methanol
Authors of publication	Dai, Jun-Wei; Li, Xing; Zheng, Jian-Mei; Dong, Xin; Zhou, Zhao-Hui
Journal of publication	Journal of Solid State Chemistry
Year of publication	2016
Journal volume	237
Pages of publication	364 - 370
a	10.4941 ± 0.0003 Å
b	22.7391 ± 0.0006 Å
c	9.7704 ± 0.0003 Å
α	90°
β	108.208 ± 0.003°
γ	90°
Cell volume	2214.73 ± 0.12 Å³
Cell temperature	153 ± 0.1 K
Ambient diffraction temperature	153 ± 0.1 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0455
Residual factor for significantly intense reflections	0.0377
Weighted residual factors for significantly intense reflections	0.0703
Weighted residual factors for all reflections included in the refinement	0.0739
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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