Crystallography Open Database

Information card for entry 7118505

Preview

Coordinates	7118505.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C1.33 H9.77 Al B5 N1.33 O10.88
Calculated formula	C1.33333 H9 Al B5 N1.33333 O10.8833
Title of publication	A zeolite CAN-type aluminoborate with gigantic 24-ring channels.
Authors of publication	Cao, Gao-Juan; Wei, Qi; Cheng, Jian-Wen; Cheng, Lin; Yang, Guo-Yu
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2016
Journal volume	52
Journal issue	8
Pages of publication	1729 - 1732
a	21.4013 ± 0.0008 Å
b	21.4013 ± 0.0008 Å
c	7.1696 ± 0.0005 Å
α	90°
β	90°
γ	120°
Cell volume	2843.8 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	173
Hermann-Mauguin space group symbol	P 63
Hall space group symbol	P 6c
Residual factor for all reflections	0.0571
Residual factor for significantly intense reflections	0.0532
Weighted residual factors for significantly intense reflections	0.1626
Weighted residual factors for all reflections included in the refinement	0.1664
Goodness-of-fit parameter for all reflections included in the refinement	1.087
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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