Crystallography Open Database

Information card for entry 7039930

Preview

Coordinates	7039930.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H32 B2 F8 Fe N14 O5
Calculated formula	C30 H23 B2 F8 Fe N14 O4.45
Title of publication	Room-temperature switching of magnetic hysteresis by reversible single-crystal-to-single-crystal solvent exchange in imidazole-inspired Fe(ii) complexes.
Authors of publication	Huang, Wei; Shen, Fuxing; Zhang, Ming; Wu, Dayu; Pan, Feifei; Sato, Osamu
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	38
Pages of publication	14911 - 14918
a	9.4524 ± 0.0019 Å
b	19.536 ± 0.004 Å
c	21.598 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	3988.3 ± 1.4 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	7
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.2754
Residual factor for significantly intense reflections	0.085
Weighted residual factors for significantly intense reflections	0.1979
Weighted residual factors for all reflections included in the refinement	0.2313
Goodness-of-fit parameter for all reflections included in the refinement	0.603
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
187056 (current)	2016-10-08	cif/ Updating files of 7039927, 7039928, 7039929, 7039930 Original log message: Adding full bibliography for 7039927--7039930.cif.	7039930.cif
184540	2016-07-20	cif/ Adding structures of 7039927, 7039928, 7039929, 7039930 via cif-deposit CGI script.	7039930.cif