Crystallography Open Database

Information card for entry 4310618

Preview

Coordinates	4310618.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C68 H104 Al2 N5 O3
Calculated formula	C68 H104 Al2 N5 O3
Title of publication	Synthesis and Structural Characterization of a Terminal Hydroxide Containing Alumoxane via Hydrolysis of Aluminum Hydrides
Authors of publication	Ying Peng; Guangcai Bai; Hongjun Fan; Denis Vidovic; Herbert W. Roesky; Jörg Magull
Journal of publication	Inorganic Chemistry
Year of publication	2004
Journal volume	43
Pages of publication	1217 - 1219
a	14.128 ± 0.003 Å
b	21.5 ± 0.004 Å
c	22.083 ± 0.004 Å
α	90°
β	98.01 ± 0.03°
γ	90°
Cell volume	6642 ± 2 Å³
Cell temperature	133 ± 2 K
Ambient diffraction temperature	133 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1009
Residual factor for significantly intense reflections	0.0484
Weighted residual factors for significantly intense reflections	0.0935
Weighted residual factors for all reflections included in the refinement	0.1035
Goodness-of-fit parameter for all reflections included in the refinement	0.722
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179145 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/06.	4310618.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4310618.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4310618.cif
2106	2010-11-08	../uploads/cif-deposit/cod/cif Adding structures of 4310618 via cif-deposit CGI script.	4310618.cif