Crystallography Open Database

Information card for entry 4342171

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Coordinates	4342171.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H35 Br0.13 Eu N11.88 O12.63
Calculated formula	C27 H27 Br0.133 Eu N11.867 O12.601
Title of publication	Lanthanide(III) Complexation with an Amide Derived Pyridinophane.
Authors of publication	Castro, Goretti; Bastida, Rufina; Macías, Alejandro; Pérez-Lourido, Paulo; Platas-Iglesias, Carlos; Valencia, Laura
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	4
Pages of publication	1671 - 1683
a	19.478 ± 0.002 Å
b	16.6398 ± 0.0018 Å
c	21.093 ± 0.002 Å
α	90°
β	93.15 ± 0.002°
γ	90°
Cell volume	6826.1 ± 1.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
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	0.0567
Residual factor for significantly intense reflections	0.0449
Weighted residual factors for significantly intense reflections	0.114
Weighted residual factors for all reflections included in the refinement	0.1256
Goodness-of-fit parameter for all reflections included in the refinement	1.054
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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