Crystallography Open Database

Information card for entry 7059326

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Coordinates	7059326.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C H38 B24 K15 N2 Na O68
Calculated formula	C H37.9998 B24 K15 N2 Na O67.998
Title of publication	NaK15[B4O5(OH)4]6(NO2)2(CO3)·7H2O: assembly of an unprecedented mixed anion inorganic compound via a facile hydrothermal route
Authors of publication	Cao, Yuchen; Zhang, Bingbing; Liu, Hongkun; Li, Danni; Wang, Ying
Journal of publication	New Journal of Chemistry
Year of publication	2020
Journal volume	44
Journal issue	11
Pages of publication	4253 - 4256
a	11.1399 ± 0.0009 Å
b	11.1399 ± 0.0009 Å
c	30.495 ± 0.005 Å
α	90°
β	90°
γ	120°
Cell volume	3277.3 ± 0.7 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	7
Space group number	190
Hermann-Mauguin space group symbol	P -6 2 c
Hall space group symbol	P -6c -2c
Residual factor for all reflections	0.0384
Residual factor for significantly intense reflections	0.0316
Weighted residual factors for significantly intense reflections	0.0801
Weighted residual factors for all reflections included in the refinement	0.0844
Goodness-of-fit parameter for all reflections included in the refinement	1.106
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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