Crystallography Open Database

Information card for entry 7029493

Preview

Coordinates	7029493.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H20 Al O10 P3
Calculated formula	C12 H20 Al O10 P3
Title of publication	A highly porous three-dimensional aluminum phosphonate with hexagonal channels: synthesis, structure and adsorption properties.
Authors of publication	Tang, Si-Fu; Cai, Jin-Jun; Li, Liang-Jun; Lv, Xiao-Xia; Wang, Chao; Zhao, Xue-Bo
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	16
Pages of publication	5970 - 5973
a	35.285 ± 0.003 Å
b	35.285 ± 0.003 Å
c	12.398 ± 0.003 Å
α	90°
β	90°
γ	120°
Cell volume	13368 ± 4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.1184
Residual factor for significantly intense reflections	0.0567
Weighted residual factors for significantly intense reflections	0.1223
Weighted residual factors for all reflections included in the refinement	0.1495
Goodness-of-fit parameter for all reflections included in the refinement	0.998
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
180000 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/94.	7029493.cif
108324	2014-03-30	cif/ Adding structures of 7029493 via cif-deposit CGI script.	7029493.cif