Crystallography Open Database

Information card for entry 1528154

Preview

Coordinates	1528154.cif

Structure parameters

Chemical name	Na4 Fe (C N)6 (H2 O)10
Formula	C6 H20 Fe N6 Na4 O10
Calculated formula	C6 H20 Fe N6 Na4 O10
SMILES	O.O.O.O.[Na+].O.[Fe](C#N)(C#N)(C#N)(C#N)(C#N)C#N.[Na+].O.O.O.O.[Na+].O.[Na+]
Title of publication	The crystal structures of Na4 Fe (C N)6 (H2 O)10 and Na4 Mn (C N)6 (H2 O)10
Authors of publication	Tullberg, A.; Vannerberg, N.G.
Journal of publication	Acta Chemica Scandinavica (1-27,1973-42,1988)
Year of publication	1971
Journal volume	25
Pages of publication	343 - 344
a	9.8 Å
b	11.4 Å
c	9 Å
α	90°
β	97.5°
γ	90°
Cell volume	996.878 Å³
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
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
186638 (current)	2016-09-18	cif/1/ (antanas@kurmis) Adding attached hydrogens to O atoms.	1528154.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.	1528154.cif
176428	2016-02-13	cif/ (antanas@kurmis) Replacing _cod_cif_authors_sg_Hall tag with _cod_original_sg_symbol_Hall tag and _cod_cif_authors_sg_H-M tag with _cod_original_sg_symbol_H-M tag in multiple entries sine the replaced tags are deprecated according to the COD CIF dictionary.	1528154.cif
150099	2015-07-13	cif/ Adding structures of 1528154 via cif-deposit CGI script.	1528154.cif