Crystallography Open Database

Information card for entry 7206479

7206478 << 7206479 >> 7206480

Preview

Coordinates	7206479.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C102 H114 K3 Mo N20 Ni4 O16 S6
Calculated formula	C102 H114 K3 Mo N20 Ni4 O16 S6
Title of publication	Oligomeric and polymeric organizations of potassium salts with compartmental Schiff-base complexes as ligands
Authors of publication	Mousavi, Maliheh; Béreau, Virginie; Costes, Jean-Pierre; Duhayon, Carine; Sutter, Jean-Pascal
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	19
Pages of publication	5908
a	14.1659 ± 0.0004 Å
b	15.115 ± 0.0004 Å
c	15.5887 ± 0.0004 Å
α	73.08 ± 0.001°
β	64.458 ± 0.001°
γ	88.402 ± 0.002°
Cell volume	2862.77 ± 0.14 Å³
Cell temperature	180 K
Ambient diffraction temperature	180 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0597
Residual factor for significantly intense reflections	0.0387
Weighted residual factors for all reflections	0.0809
Weighted residual factors for significantly intense reflections	0.0403
Weighted residual factors for all reflections included in the refinement	0.0386
Goodness-of-fit parameter for all reflections included in the refinement	1
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7206479.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7206479.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7206479.cif
27996	2011-10-13	../uploads/cif-deposit/cod/cif Adding structures of 7206479, 7206480, 7206481, 7206482, 7206483 via cif-deposit CGI script.	7206479.cif