Crystallography Open Database

Information card for entry 4320461

4320460 << 4320461 >> 4320462

Preview

Coordinates	4320461.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C2 H9 Al3 N O13 P3
Calculated formula	C2 H9 Al3 N O13 P3
Title of publication	A Simulation Study on the Topotactic Transformations from Aluminophosphate AlPO4-21 to AlPO4-25
Authors of publication	Jiyang Li; Jihong Yu; Kaixue Wang; Guangshan Zhu; Ruren Xu
Journal of publication	Inorganic Chemistry
Year of publication	2001
Journal volume	40
Pages of publication	5812 - 5817
a	8.6868 ± 0.0019 Å
b	17.428 ± 0.005 Å
c	9.1589 ± 0.0017 Å
α	90°
β	109.604 ± 0.017°
γ	90°
Cell volume	1306.2 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0693
Residual factor for significantly intense reflections	0.038
Weighted residual factors for significantly intense reflections	0.0806
Weighted residual factors for all reflections included in the refinement	0.0903
Goodness-of-fit parameter for all reflections included in the refinement	0.877
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
179307 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/04.	4320461.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4320461.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4320461.cif
17657	2011-04-09	../uploads/cif-deposit/cod/cif Adding structures of 4320461 via cif-deposit CGI script.	4320461.cif