Crystallography Open Database

Information card for entry 7026772

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Structure parameters

Formula	C28 H24 Cl2 Co N4 O10
Calculated formula	C28 H24 Cl2 Co N4 O10
Title of publication	Preparation and characterisation of divalent hard and soft metal (M = Ca, Co, Cu, Zn, Cd, Hg and Pb) complexes of 1,10-dithia-18-crown-6: structural versatility.
Authors of publication	Park, In-Hyeok; Park, Ki-Min; Lee, Shim Sung
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	40
Pages of publication	9696 - 9704
a	10.455 ± 0.002 Å
b	14.087 ± 0.003 Å
c	11.199 ± 0.003 Å
α	90°
β	106.144 ± 0.004°
γ	90°
Cell volume	1584.3 ± 0.6 Å³
Cell temperature	174 ± 2 K
Ambient diffraction temperature	174 ± 2 K
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
Residual factor for all reflections	0.0404
Residual factor for significantly intense reflections	0.0332
Weighted residual factors for significantly intense reflections	0.0845
Weighted residual factors for all reflections included in the refinement	0.0893
Goodness-of-fit parameter for all reflections included in the refinement	1.035
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
301848 (current)	2025-08-21	Add cross-references to PubChem compounds in COD range 7/02/ Each referenced PubChem compound corresponds to the full crystal structure.	7026772.cif
179973	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/67.	7026772.cif
93596	2014-01-13	cif/ Adding structures of 7026770, 7026771, 7026772, 7026773, 7026774, 7026775, 7026776, 7026777, 7026778, 7026779, 7026780 via cif-deposit CGI script.	7026772.cif