Crystallography Open Database

Information card for entry 4308074

Preview

Coordinates	4308074.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Al7 Ca6 O16.52
Calculated formula	Al7 Ca6 O16.5208
Title of publication	Crystal Structures and in-Situ Formation Study of Mayenite Electrides
Authors of publication	Luis Palacios; Ángeles G. De La Torre; Sebastián Bruque; Jose L. García-Muñoz; Santiago García-Granda; Denis Sheptyakov; Miguel A. G. Aranda
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	4167 - 4176
a	11.986813 ± 0.000005 Å
b	11.986813 Å
c	11.986813 Å
α	90°
β	90°
γ	90°
Cell volume	1722.31 ± 0.0007 Å³
Number of distinct elements	3
Space group number	220
Hermann-Mauguin space group symbol	I -4 3 d
Hall space group symbol	I -4bd 2c 3
Goodness-of-fit parameter for all reflections	0.58
Method of determination	powder diffraction
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4308074.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4308074.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4308074.cif
5312	2011-01-03	cif/ Adding files, updated with the 'cif_fix_enum' program and the cif_core.dic dictionary. The enumerator values were fixed, mostly incorrect case, but also some values that had extra underscores, dashes or spaces. Unfortunately, 22 had non-ASCII characters with the 8-th bit set, and these got incorrectly interpreted as latin1 characters and converted to their UTF8 equivalents by Perl. To fix the structures, however, they need to be redeposited from the original files with the new CIFParser/cif_filter version.	4308074.cif
1194	2010-06-06	cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory.	4308074.cif