Crystallography Open Database

Information card for entry 7715184

Preview

Coordinates	7715184.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H26 Br4 Cl2 Co N6 O8
Calculated formula	C38 H26 Br4 Cl2 Co N6 O8
Title of publication	How the spin state tunes the slow magnetic relaxation field dependence in spin crossover cobalt(II) complexes.
Authors of publication	Rabelo, Renato; Toma, Luminita; Julve, Miguel; Lloret, Francesc; Pasán, Jorge; Cangussu, Danielle; Ruiz-García, Rafael; Cano, Joan
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	12
Pages of publication	5507 - 5520
a	8.1978 ± 0.0001 Å
b	41.0395 ± 0.0006 Å
c	36.5103 ± 0.0004 Å
α	90°
β	93.874 ± 0.001°
γ	90°
Cell volume	12255.2 ± 0.3 Å³
Cell temperature	150 ± 0.1 K
Ambient diffraction temperature	150 ± 0.1 K
Number of distinct elements	7
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	0.0899
Residual factor for significantly intense reflections	0.0625
Weighted residual factors for significantly intense reflections	0.1269
Weighted residual factors for all reflections included in the refinement	0.1391
Goodness-of-fit parameter for all reflections included in the refinement	1.08
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
290995 (current)	2024-04-05	cif/ Updating files of 7715184, 7715185, 7715186, 7715187 Original log message: Adding full bibliography for 7715184--7715187.cif.	7715184.cif
289889	2024-02-21	cif/ Adding structures of 7715184, 7715185, 7715186, 7715187 via cif-deposit CGI script.	7715184.cif