Crystallography Open Database

Information card for entry 7061045

Preview

Coordinates	7061045.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34.3 H41.56 N3.65 O11 Ru
Calculated formula	C34.302 H41.557 N3.651 O11 Ru
Title of publication	Ruthenium macrocycles bearing pyridine bis(carboxamide): synthesis, structure, and catalytic activity for hydrosilylation
Authors of publication	Sato, Hiroki; Tsukamoto, Tadashi; Sogawa, Hiromitsu; Kuwata, Shigeki; Takata, Toshikazu
Journal of publication	New Journal of Chemistry
Year of publication	2021
Journal volume	45
Journal issue	39
Pages of publication	18282 - 18289
a	10.629 ± 0.004 Å
b	12.451 ± 0.004 Å
c	15.252 ± 0.005 Å
α	68.755 ± 0.018°
β	77.07 ± 0.02°
γ	74.08 ± 0.02°
Cell volume	1791.6 ± 1.1 Å³
Cell temperature	93 K
Ambient diffraction temperature	93 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0668
Residual factor for significantly intense reflections	0.049
Weighted residual factors for significantly intense reflections	0.1146
Weighted residual factors for all reflections included in the refinement	0.1229
Goodness-of-fit parameter for all reflections included in the refinement	0.986
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
270327 (current)	2021-11-06	cif/ Adding structures of 7061045, 7061046, 7061047, 7061048 via cif-deposit CGI script.	7061045.cif