Crystallography Open Database

Information card for entry 8106239

Preview

Coordinates	8106239.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H15 La N4 O8
Calculated formula	C16 H15 La N4 O8
Title of publication	Crystal structure of diaqua-(acetato-κ3 O,O′:O′′)-(μ3-4,6-di(1H-imidazol-1-yl)isophthalato-κ4 O:O′:O′′,O′′′)lanthanum(III), C16H15LaN4O8
Authors of publication	Liu, Xue-Guo; Yan, Wei-Hong; Xing, Xiao-Jing; Fan, Hui-Tao
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2018
Journal volume	233
Journal issue	4
Pages of publication	631 - 632
a	13.237 ± 0.0006 Å
b	15.4658 ± 0.0005 Å
c	9.5723 ± 0.0004 Å
α	90°
β	108.834 ± 0.004°
γ	90°
Cell volume	1854.73 ± 0.14 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.0391
Residual factor for significantly intense reflections	0.0342
Weighted residual factors for significantly intense reflections	0.0778
Weighted residual factors for all reflections included in the refinement	0.0814
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

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/8106239.html