Crystallography Open Database

Information card for entry 4124012

Preview

Coordinates	4124012.cif

Structure parameters

Chemical name	Na K3 Mo O2 (C N)4 (H2 O)6
Formula	C4 H12 K3 Mo N4 Na O8
Calculated formula	C4 K3 Mo N4 Na O8
SMILES	C(#N)[Mo](C#N)(C#N)(C#N)(=O)=O.[K+].[Na+].O.[K+].O.O.[K+].O.O.O
Title of publication	The Structure of the trans-Dioxotetracyanomolybdate(IV) Ion in the Crystalline Salt Na K3 Mo O2 (C N)4 (H2 O)6
Authors of publication	Day, V.W.; Hoard, J.L.
Journal of publication	Journal of the American Chemical Society
Year of publication	1968
Journal volume	90
Pages of publication	3374 - 3379
a	12.46 Å
b	7.161 Å
c	9.171 Å
α	90°
β	90°
γ	90°
Cell volume	818.292 Å³
Number of distinct elements	7
Space group number	53
Hermann-Mauguin space group symbol	P m n a
Hall space group symbol	-P 2ac 2
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176429 (current)	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.	4124012.cif
150656	2015-07-13	cif/ Adding structures of 4124012 via cif-deposit CGI script.	4124012.cif