Crystallography Open Database

Information card for entry 7210296

Preview

Coordinates	7210296.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C7 H8 O6.5 P Zn
Calculated formula	C7 H4 O6.5 P Zn
Title of publication	Controllable preparation and structures of two zinc phosphonocarboxylate frameworks with MER and RHO zeolitic topologies
Authors of publication	Deng, Mingli; Liu, Xiaofeng; Zheng, Qingshu; Chen, Zhenxia; Fang, Changye; Yue, Bin; He, Heyong
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	35
Pages of publication	7056
a	23.986 ± 0.006 Å
b	23.986 ± 0.006 Å
c	10.481 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	6030 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	126
Hermann-Mauguin space group symbol	P 4/n n c :2
Hall space group symbol	-P 4a 2bc
Residual factor for all reflections	0.0962
Residual factor for significantly intense reflections	0.0866
Weighted residual factors for significantly intense reflections	0.2631
Weighted residual factors for all reflections included in the refinement	0.274
Goodness-of-fit parameter for all reflections included in the refinement	1.017
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7210296.cif
87589	2013-08-27	cif/ Adding structures of 7210296, 7210297 via cif-deposit CGI script.	7210296.cif