Crystallography Open Database

Information card for entry 7009726

Preview

Coordinates	7009726.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4 H16 Al N3 O8 P2
Calculated formula	C4 H16 Al N3 O8 P2
Title of publication	A new layered aluminophosphate [Al2P4O16][C6H22N4][C2H10N2] with 4.12-net porous sheets
Authors of publication	Wei, Bo; Yu, Jihong; Shi, Zhan; Qiu, Shilun; Li, Jiyang
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2000
Journal issue	13
Pages of publication	1979
a	10.8264 ± 0.0011 Å
b	8.1432 ± 0.0008 Å
c	13.7698 ± 0.0013 Å
α	90°
β	95.104 ± 0.002°
γ	90°
Cell volume	1209.2 ± 0.2 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	0.0327
Residual factor for significantly intense reflections	0.0285
Weighted residual factors for significantly intense reflections	0.0836
Weighted residual factors for all reflections included in the refinement	0.0863
Goodness-of-fit parameter for all reflections included in the refinement	1.083
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
179801 (current)	2016-03-25	cif/7/00/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/00/97.	7009726.cif
120443	2014-07-15	Adding 17924 DOIs guessed from source file names.	7009726.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7009726.cif
3896	2010-12-08	cif/7/ Adding CIFs with data from Dalton-Trans-2004-2000/.	7009726.cif