Crystallography Open Database





Information card for 7205978

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Coordinates

7205978.cif

Structure parameters

Formula - C4 H20 Be3 N2 O12 P4 -
Calculated formula - C4 H20 Be3 N2 O12 P4 -
Title of publication (C2H8N)2[Be3(HPO3)4]: a low-density beryllium phosphite with large 16-membered rings and helical channels
Authors of publication Luo, Xiuchao; Luo, Daibing; Gong, Maochu; Chen, Yaoqiang; Lin, Zhien
Journal of publication CrystEngComm
Year of publication 2011
Journal volume 13
Journal issue 11
Pages of publication 3646
a 14.6905 ± 0.0008 Å
b 8.0472 ± 0.0004 Å
c 15.8688 ± 0.0002 Å
α 90°
β 112.929 ± 0.007°
γ 90°
Cell volume 1727.74 ± 0.16 Å3
Cell temperature 293 ± 2 K
Ambient diffraction temperature 293 ± 2 K
Number of distinct elements 6
Hermann-Mauguin symmetry space group C 1 2/c 1
Hall symmetry space group -C 2yc
Residual factor for all reflections 0.0486
Residual factor for observed reflections 0.0398
Weighted residual factors for the observed reflections 0.0896
Weighted residual factors for all reflections included in the refinement 0.0939
Goodness-of-fit parameter for observed reflections 1.107
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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