Crystallography Open Database

Information card for entry 7711114

Preview

Coordinates	7711114.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H14 N7 O10 Tb
Calculated formula	C6 H14 N7 O10 Tb
Title of publication	S-Heptazine N-Ligand Based Luminescent Coordination Materials: Synthesis, Structural and Luminescent Studies of Lanthanide-Cyamelurate Networks
Authors of publication	Essalhi, Mohamed; Mohan, Midhun; Marineau-Plante, Gabriel; Schlachter, Adrien Camille; Maris, Thierry; Harvey, Pierre D.; Duong, Adam
Journal of publication	Dalton Transactions
Year of publication	2022
a	11.8582 ± 0.0004 Å
b	6.8416 ± 0.0002 Å
c	16.6967 ± 0.0005 Å
α	90°
β	93.7 ± 0.001°
γ	90°
Cell volume	1351.76 ± 0.07 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0265
Residual factor for significantly intense reflections	0.0248
Weighted residual factors for significantly intense reflections	0.0616
Weighted residual factors for all reflections included in the refinement	0.0626
Goodness-of-fit parameter for all reflections included in the refinement	1.074
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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