Crystallography Open Database

Information card for entry 4103449

Preview

Coordinates	4103449.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C0.4 Be1.6 K3.2 N0.4 O12 Si6.4
Calculated formula	C2.864 Be1.6 K3.128 N0.672 O16.768 Si6.4
Title of publication	Beryllosilicate Frameworks and Zeolites
Authors of publication	Jennifer A. Armstrong; Mark T. Weller
Journal of publication	Journal of the American Chemical Society
Year of publication	2010
Journal volume	132
Pages of publication	15679 - 15686
a	12.7069 ± 0.0009 Å
b	13.2309 ± 0.0007 Å
c	13.9362 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	2343 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0973
Residual factor for significantly intense reflections	0.1266
Weighted residual factors for significantly intense reflections	0.1574
Weighted residual factors for all reflections included in the refinement	0.1315
Goodness-of-fit parameter for all reflections included in the refinement	1.112
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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