Crystallography Open Database

Information card for entry 1561206

Preview

Coordinates	1561206.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H36 Cu La2 N16 O22
Calculated formula	C14 H36 Cu La2 N16 O22
Title of publication	Regulation of deprotonation of 3,3-di(1H-tetrazol-5-yl)pentanedioic acid: Solvothermal synthesis of La(III) and heterometallic La(III)/Cu(II) compounds for ablation of A549 cells
Authors of publication	Guo, Meng Yue; Zhang, Xin; Zhao, Liang; Li, Yue Kang; Chen, Dian Yu; Yang, Gao Wen; Li, Qiao Yun
Journal of publication	Journal of Solid State Chemistry
Year of publication	2018
Journal volume	259
Pages of publication	104 - 109
a	9.449 ± 0.004 Å
b	12.455 ± 0.005 Å
c	15.1 ± 0.006 Å
α	90°
β	104.403 ± 0.004°
γ	90°
Cell volume	1721.2 ± 1.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 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	0.0282
Residual factor for significantly intense reflections	0.0275
Weighted residual factors for significantly intense reflections	0.1222
Weighted residual factors for all reflections included in the refinement	0.1235
Goodness-of-fit parameter for all reflections included in the refinement	1.11
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
263250 (current)	2021-03-23	cif/ Adding structures of 1561206 via cif-deposit CGI script.	1561206.cif