Crystallography Open Database

Information card for entry 4321401

Preview

Coordinates	4321401.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25.5 H29.5 Cl Co Cu N4.5 O6.5 S
Calculated formula	C25.5 H26 Cl Co Cu N4.5 O6.5 S
Title of publication	A Heterodinuclear CoIICuI Complex with Co(salen) in a Macrocyclic Framework. Oxygenation Studies in Comparison with Analogous CuIICuI and CoIIPbII Complexes
Authors of publication	Misato Shinoura; Satoru Kita; Masaaki Ohba; Hisashi Ōkawa; Hideki Furutachi; Masatatsu Suzuki
Journal of publication	Inorganic Chemistry
Year of publication	2000
Journal volume	39
Pages of publication	4520 - 4526
a	7.087 ± 0.001 Å
b	19.593 ± 0.006 Å
c	19.447 ± 0.003 Å
α	90°
β	96.29 ± 0.01°
γ	90°
Cell volume	2684.1 ± 1 Å³
Cell temperature	288.2 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for significantly intense reflections	0
Weighted residual factors for all reflections included in the refinement	0.049
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4321401.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4321401.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4321401.cif
18771	2011-05-04	../uploads/cif-deposit/cod/cif Adding structures of 4321401 via cif-deposit CGI script.	4321401.cif