Crystallography Open Database

Information card for entry 4001221

Preview

Coordinates	4001221.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H19 Al6 N4 O28 P7
Calculated formula	C10 H19 Al6 N4 O28 P7
Title of publication	Cotemplating Ionothermal Synthesis of a New Open-Framework Aluminophosphate with Unique Al/P Ratio of 6/7
Authors of publication	Xing, Hongzhu; Li, Jiyang; Yan, Wenfu; Chen, Peng; Jin, Zhao; Yu, Jihong; Dai, Sheng; Xu, Ruren
Journal of publication	Chemistry of Materials
Year of publication	2008
Journal volume	20
Journal issue	13
Pages of publication	4179
a	9.015 ± 0.0005 Å
b	9.4739 ± 0.0006 Å
c	19.7373 ± 0.0011 Å
α	88.964 ± 0.001°
β	78.938 ± 0.001°
γ	85.489 ± 0.001°
Cell volume	1649.25 ± 0.17 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0703
Residual factor for significantly intense reflections	0.0572
Weighted residual factors for significantly intense reflections	0.1592
Weighted residual factors for all reflections included in the refinement	0.1736
Goodness-of-fit parameter for all reflections included in the refinement	1.072
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
178377 (current)	2016-03-21	cif/4/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/00.	4001221.cif
120073	2014-07-11	Adding DOIs to range 4/00 structures.	4001221.cif
41922	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4001221 via cif-deposit CGI script.	4001221.cif