Crystallography Open Database

Information card for entry 7048363

Preview

Coordinates	7048363.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H26 Cl2 Cu2 N2 O11 S2
Calculated formula	C24 H26 Cl2 Cu2 N2 O11 S2
Title of publication	Thioether sulfur-bound [Cu<sub>2</sub>] complexes showing catechol oxidase activity and DNA cleaving behaviour.
Authors of publication	Das, Manisha; Afsan, Zeenat; Basak, Dipmalya; Arjmand, Farukh; Ray, Debashis
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	4
Pages of publication	1292 - 1313
a	8.566 ± 0.007 Å
b	12.777 ± 0.012 Å
c	13.867 ± 0.007 Å
α	99.18 ± 0.06°
β	91.21 ± 0.06°
γ	104.27 ± 0.08°
Cell volume	1449 ± 2 Å³
Cell temperature	299 ± 2 K
Ambient diffraction temperature	299 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.118
Residual factor for significantly intense reflections	0.055
Weighted residual factors for significantly intense reflections	0.1297
Weighted residual factors for all reflections included in the refinement	0.1585
Goodness-of-fit parameter for all reflections included in the refinement	1.068
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
224087 (current)	2019-11-07	cif/ Updating files of 7048361, 7048362, 7048363 Original log message: Adding full bibliography for 7048361--7048363.cif.	7048363.cif
212600	2018-12-15	cif/ Adding structures of 7048361, 7048362, 7048363 via cif-deposit CGI script.	7048363.cif