Crystallography Open Database

Information card for entry 7704573

Preview

Coordinates	7704573.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H24 Cl4 Cu N2 O2
Calculated formula	C30 H24 Cl4 Cu N2 O2
Title of publication	Solid-state to solution helicity inversion of pseudotetrahedral chiral copper(ii) complexes with 2,4-dihalo-salicylaldiminate ligands.
Authors of publication	Kordestani, Nazanin; Amiri Rudbari, Hadi; Bruno, Giuseppe; Rosario, Scopelliti; Braun, Jason D.; Herbert, David E.; Blacque, Olivier; Correia, Isabel; Zaman, Mohammad Al-Moktadir; Bindu, Mortuza Mamun; Janiak, Christoph; Enamullah, Mohammed
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	24
Pages of publication	8247 - 8264
a	8.6322 ± 0.0002 Å
b	14.8439 ± 0.0003 Å
c	11.1572 ± 0.0003 Å
α	90°
β	97.871 ± 0.001°
γ	90°
Cell volume	1416.16 ± 0.06 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0378
Residual factor for significantly intense reflections	0.0288
Weighted residual factors for significantly intense reflections	0.0659
Weighted residual factors for all reflections included in the refinement	0.0729
Goodness-of-fit parameter for all reflections included in the refinement	0.993
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
253862 (current)	2020-07-06	cif/ Updating files of 7704565, 7704566, 7704567, 7704568, 7704569, 7704570, 7704571, 7704572, 7704573 Original log message: Adding full bibliography for 7704565--7704573.cif.	7704573.cif
252560	2020-06-03	cif/ Adding structures of 7704565, 7704566, 7704567, 7704568, 7704569, 7704570, 7704571, 7704572, 7704573 via cif-deposit CGI script.	7704573.cif