Crystallography Open Database

Information card for entry 1521321

Preview

Coordinates	1521321.cif
External links	PubChem

Structure parameters

Formula	Ba
Calculated formula	Ba
SMILES	[Ba]
Title of publication	Structure determination by electron diffraction and HREM of the incommensurate modulated phase Bax Cu O2 (0.67 < x < 0.70)
Authors of publication	Migliori, A.; Gemmi, M.; Belletti, D.; Calestani, G.; Nozar, P.; Matacotta, F.C.; Dionigi, C.
Journal of publication	Physica C (Amsterdam)
Year of publication	1999
Journal volume	328
Pages of publication	89 - 103
a	5.7 Å
b	7.3 Å
c	3.91 Å
α	90°
β	90°
γ	90°
Cell volume	162.695 Å³
Number of distinct elements	1
Space group number	65
Hermann-Mauguin space group symbol	A m m m
Hall space group symbol	-A 2 2
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
301777 (current)	2025-08-18	Add cross-references to PubChem compounds in COD range 1/52 Each referenced PubChem compound corresponds to the full crystal structure.	1521321.cif
211196	2018-09-27	cod/ Removing the _chemical_name_common and _chemical_name_systematic data items that contained the summary chemical formula instead of the chemical name from 6249 entries.	1521321.cif
176429	2016-02-13	cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary.	1521321.cif
176428	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	1521321.cif
141067	2015-07-08	cif/ Adding structures of 1521321 via cif-deposit CGI script.	1521321.cif