Crystallography Open Database

Information card for entry 1530938

Preview

Coordinates	1530938.cif
External links	PubChem

Structure parameters

Chemical name	Ba Cl2 (H2 O)
Formula	Ba Cl2 H2 O
Calculated formula	Ba Cl2 H2 O
Title of publication	The electron diffraction determination of structure of barium chloride monohydrate - Ba Cl2 H2 O
Authors of publication	Vainshtein, B.K.; Pinsker, Z.G.
Journal of publication	Zhurnal Fizicheskoi Khimii
Year of publication	1949
Journal volume	23
Pages of publication	1058 - 1069
a	4.51 Å
b	9.02 Å
c	11.28 Å
α	90°
β	90°
γ	90°
Cell volume	458.873 Å³
Number of distinct elements	4
Space group number	62
Hermann-Mauguin space group symbol	P m c n
Hall space group symbol	-P 2n 2a
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
301778 (current)	2025-08-18	Add cross-references to PubChem compounds in COD range 1/53 Each referenced PubChem compound corresponds to the full crystal structure.	1530938.cif
189186	2016-12-18	cif/1 (antanas@echidna.ibt.lt) Marking attached hydrogen atoms.	1530938.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.	1530938.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.	1530938.cif
156172	2015-09-12	cif/ Adding structures of 1530938 via cif-deposit CGI script.	1530938.cif