Crystallography Open Database

Information card for entry 7219468

7219467 << 7219468 >> 7219469

Preview

Coordinates	7219468.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H27 Be5 N4 O28 P7
Calculated formula	C20 H27 Be5 N4 O28 P7
Title of publication	Open-framework beryllium phosphates with a zeolitic CrB4topology and their structural analogues containing 12-ring channels
Authors of publication	Wang, Kangcai; Li, Jing; Xu, Dingguo; Luo, Daibing; Lin, Zhien
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	10
Pages of publication	2162
a	14.6958 ± 0.0004 Å
b	11.6451 ± 0.0004 Å
c	20.5912 ± 0.0006 Å
α	90°
β	93.811 ± 0.002°
γ	90°
Cell volume	3516.06 ± 0.19 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0472
Residual factor for significantly intense reflections	0.0415
Weighted residual factors for significantly intense reflections	0.0926
Weighted residual factors for all reflections included in the refinement	0.0955
Goodness-of-fit parameter for all reflections included in the refinement	1.069
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180525 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/94.	7219468.cif
133173	2015-03-06	cif/ Updating files of 7219466, 7219467, 7219468, 7219469 Original log message: Adding full bibliography for 7219466--7219469.cif.	7219468.cif
130901	2015-02-04	cif/ Adding structures of 7219466, 7219467, 7219468, 7219469 via cif-deposit CGI script.	7219468.cif