Crystallography Open Database

Information card for entry 4350764

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Coordinates	4350764.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H31.98 N12 O25 Sm2
Calculated formula	C33 H31.98 N12 O25 Sm2
Title of publication	Sm and Eu(iii) lanthanide triple helicate cages based on N,N′-methylene-bis(pyridin-4-one)
Authors of publication	Shu, Yu-Bo; Tang, Xiao-Liang; Liu, Wei-Sheng
Journal of publication	Inorg. Chem. Front.
Year of publication	2014
Journal volume	1
Journal issue	3
Pages of publication	226
a	14.3524 ± 0.0007 Å
b	14.3524 ± 0.0007 Å
c	19.1378 ± 0.0008 Å
α	90°
β	90°
γ	120°
Cell volume	3414.1 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	146
Hermann-Mauguin space group symbol	R 3 :H
Hall space group symbol	R 3
Residual factor for all reflections	0.0233
Residual factor for significantly intense reflections	0.0209
Weighted residual factors for significantly intense reflections	0.0383
Weighted residual factors for all reflections included in the refinement	0.0389
Goodness-of-fit parameter for all reflections included in the refinement	0.983
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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