Crystallography Open Database

Information card for entry 4337633

Preview

Coordinates	4337633.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H38 Cu3 N8 O12 S4
Calculated formula	C38 H34 Cu3 N8 O12 S4
Title of publication	A versatile dinucleating ligand containing sulfonamide groups.
Authors of publication	Sundberg, Jonas; Witt, Hannes; Cameron, Lisa; Håkansson, Mikael; Bendix, Jesper; McKenzie, Christine J.
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	6
Pages of publication	2873 - 2882
a	25.662 ± 0.004 Å
b	9.2714 ± 0.0014 Å
c	20.309 ± 0.003 Å
α	90°
β	97.787 ± 0.006°
γ	90°
Cell volume	4787.4 ± 1.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0499
Residual factor for significantly intense reflections	0.0445
Weighted residual factors for significantly intense reflections	0.1359
Weighted residual factors for all reflections included in the refinement	0.1395
Goodness-of-fit parameter for all reflections included in the refinement	1.01
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4337633.html