Crystallography Open Database

Information card for entry 1562244

Preview

Coordinates	1562244.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H10 N3 Nd O10 S3
Calculated formula	C9 H8 N3 Nd O10 S3
Title of publication	Syntheses, structures, molecular and cationic recognitions and catalytic properties of two lanthanide coordination polymers based on a flexible tricarboxylate
Authors of publication	Zhu, Yu; Wang, Yan-Mei; Xu, Ji; Liu, Pan; Weththasinha, H.A.B.M.D.; Wu, Yun-Long; Lu, Xiao-Qing; Xie, Ji-Min
Journal of publication	Journal of Solid State Chemistry
Year of publication	2014
Journal volume	219
Pages of publication	259 - 264
a	8.7281 ± 0.0017 Å
b	14.495 ± 0.003 Å
c	15.445 ± 0.005 Å
α	90°
β	121.07 ± 0.02°
γ	90°
Cell volume	1673.7 ± 0.8 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	6
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	0.1459
Residual factor for significantly intense reflections	0.1414
Weighted residual factors for significantly intense reflections	0.3259
Weighted residual factors for all reflections included in the refinement	0.3278
Goodness-of-fit parameter for all reflections included in the refinement	1.086
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
264685 (current)	2021-04-29	cif/ Adding structures of 1562243, 1562244 via cif-deposit CGI script.	1562244.cif