Crystallography Open Database

Information card for entry 7056380

Preview

Coordinates	7056380.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H14 Br Cl2 F6 N4 O P Ru
Calculated formula	C21 H14 Br Cl2 F6 N4 O P Ru
Title of publication	Photorelease of nitric oxide (NO) on ruthenium nitrosyl complexes with phenyl substituted terpyridines
Authors of publication	Amabilino, Silvia; Tasse, Marine; Lacroix, Pascal G.; Mallet-Ladeira, Sonia; Pimienta, Véronique; Akl, Joëlle; Sasaki, Isabelle; Malfant, Isabelle
Journal of publication	New J. Chem.
Year of publication	2017
Journal volume	41
Journal issue	15
Pages of publication	7371 - 7383
a	10.8897 ± 0.0009 Å
b	17.2969 ± 0.0013 Å
c	13.3346 ± 0.001 Å
α	90°
β	105.353 ± 0.003°
γ	90°
Cell volume	2422 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	9
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	0.0494
Residual factor for significantly intense reflections	0.0346
Weighted residual factors for significantly intense reflections	0.0772
Weighted residual factors for all reflections included in the refinement	0.0837
Goodness-of-fit parameter for all reflections included in the refinement	1.051
Diffraction radiation probe	x-ray
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
301442 (current)	2025-08-04	Updating journal pages, volumes and years from the data sent by Robert McMeeking. cod/ (saulius@pterodaktilis)	7056380.cif
198274	2017-06-30	cif/ Adding structures of 7056375, 7056376, 7056377, 7056378, 7056379, 7056380, 7056381 via cif-deposit CGI script.	7056380.cif