Crystallography Open Database

Information card for entry 4311187

Preview

Coordinates	4311187.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C2 H10 B2 Cd N2 O13 P3
Calculated formula	C2 H10 B2 Cd N2 O13 P3
Title of publication	Hydrothermal Synthesis and Characterization of Two Organically Templated Cadmium Borophosphates with Novel Structures
Authors of publication	Wei Liu; Minghui Ge; Xinxin Yang; Haohong Chen; Manrong Li; Jingtai Zhao
Journal of publication	Inorganic Chemistry
Year of publication	2004
Journal volume	43
Pages of publication	3910 - 3914
a	9.286 ± 0.003 Å
b	12.459 ± 0.003 Å
c	21.626 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	2502 ± 1.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0378
Residual factor for significantly intense reflections	0.029
Weighted residual factors for significantly intense reflections	0.072
Weighted residual factors for all reflections included in the refinement	0.0745
Goodness-of-fit parameter for all reflections included in the refinement	1.096
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
179150 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/11.	4311187.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4311187.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4311187.cif
2679	2010-11-12	../uploads/cif-deposit/cod/cif Adding structures of 4311187 via cif-deposit CGI script.	4311187.cif