Crystallography Open Database

Information card for entry 7250916

Preview

Coordinates	7250916.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H37 B2 Co F8 N7
Calculated formula	C56 H37 B2 Co F8 N7
Title of publication	Observation of spin-crossover behaviour in Co(ii)-terpyridine complexes possessing π-conjugated substations
Authors of publication	Soejima, Keita; Sekine, Yoshihiro; Miyake, Kanta; Kiba, Kota; Yamaguchi, Yuito; Zenno, Hikaru; Hayami, Shinya
Journal of publication	RSC Advances
Year of publication	2025
Journal volume	15
Journal issue	43
Pages of publication	35892 - 35898
a	14.6941 ± 0.0004 Å
b	16.9594 ± 0.0004 Å
c	19.7961 ± 0.0005 Å
α	90°
β	104.323 ± 0.003°
γ	90°
Cell volume	4779.9 ± 0.2 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0706
Residual factor for significantly intense reflections	0.0435
Weighted residual factors for significantly intense reflections	0.1023
Weighted residual factors for all reflections included in the refinement	0.1153
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation probe	x-ray
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
302308 (current)	2025-09-30	cif/ Adding structures of 7250914, 7250915, 7250916, 7250917 via cif-deposit CGI script.	7250916.cif