Crystallography Open Database

Information card for entry 7226393

Preview

Coordinates	7226393.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H18 O18 Sm2
Calculated formula	C9 H6 O18 Sm2
Title of publication	Crystal growth and structural remarks on malonate-based lanthanide coordination polymers
Authors of publication	Delgado, Fernando S.; Lorenzo-Luís, Pablo; Pasán, Jorge; Cañadillas-Delgado, Laura; Fabelo, Oscar; Hernández-Molina, María; Lozano-Gorrín, Antonio D.; Lloret, Francesc; Julve, Miguel; Ruiz-Pérez, Catalina
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	40
Pages of publication	7831
a	17.15 ± 0.002 Å
b	12.284 ± 0.002 Å
c	11.144 ± 0.002 Å
α	90°
β	127.549 ± 0.013°
γ	90°
Cell volume	1861.3 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
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	0.043
Residual factor for significantly intense reflections	0.0321
Weighted residual factors for significantly intense reflections	0.0797
Weighted residual factors for all reflections included in the refinement	0.0897
Goodness-of-fit parameter for all reflections included in the refinement	1.16
Diffraction radiation probe	x-ray
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
188096 (current)	2016-11-08	cif/ Updating files of 7226392, 7226393, 7226394, 7226395 Original log message: Adding full bibliography for 7226392--7226395.cif.	7226393.cif
186075	2016-08-30	cif/ Adding structures of 7226392, 7226393, 7226394, 7226395 via cif-deposit CGI script.	7226393.cif