Crystallography Open Database

Information card for entry 8105495

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Coordinates	8105495.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	The crystal structure of diaqua-tris(nitrato-κ^2^<i>O</i>,<i>O</i>') -bis(4,4,5,5-tetramethyl-2-(<i>p</i>-pyridyl)imidazoline-1-oxyl 3-oxide-κ<i>N</i>)samarium(III), C~24~H~36~N~9~O~15~Sm
Formula	C24 H36 N9 O15 Sm
Calculated formula	C24 H36 N9 O15 Sm
Title of publication	The crystal structure of diaqua-tris(nitrato-κ2 O,O′)-bis(4,4,5,5-tetramethyl-2-(p-pyridyl)imidazoline-1-oxyl 3-oxide-κN)samarium(III), C24H36N9O15Sm
Authors of publication	Li, Dongjiao
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2020
Journal volume	235
Journal issue	6
Pages of publication	1463 - 1464
a	23.625 ± 0.003 Å
b	11.6837 ± 0.0012 Å
c	11.9293 ± 0.0012 Å
α	90°
β	94.646 ± 0.001°
γ	90°
Cell volume	3282 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293.15 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0192
Residual factor for significantly intense reflections	0.0173
Weighted residual factors for significantly intense reflections	0.0444
Weighted residual factors for all reflections included in the refinement	0.0449
Goodness-of-fit parameter for all reflections included in the refinement	1.069
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
276226 (current)	2022-06-24	cif/ Adding structures of 8105495 via cif-deposit CGI script.	8105495.cif