Crystallography Open Database

Information card for entry 4312608

Preview

Coordinates	4312608.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C71 H110 Cl9 N14 Nd3 O11
Calculated formula	C71 H90 Cl9 N14 Nd3 O11
Title of publication	Solid-State and Solution Properties of Cationic Lanthanide Complexes of a New Neutral Heptadentate N4O3 Tripodal Ligand
Authors of publication	Florence Bravard; Yann Bretonnière; Raphaël Wietzke; Christelle Gateau; Marinella Mazzanti; Pascale Delangle; Jacques Pécaut
Journal of publication	Inorganic Chemistry
Year of publication	2003
Journal volume	42
Pages of publication	7978 - 7989
a	17.4751 ± 0.001 Å
b	28.8954 ± 0.0017 Å
c	17.7919 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	8984 ± 0.9 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	6
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.1023
Residual factor for significantly intense reflections	0.035
Weighted residual factors for significantly intense reflections	0.0707
Weighted residual factors for all reflections included in the refinement	0.0855
Goodness-of-fit parameter for all reflections included in the refinement	0.837
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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