Crystallography Open Database

Information card for entry 1556464

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Coordinates	1556464.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H28 Br O8 Ru2
Calculated formula	C32 H28 Br O8 Ru2
SMILES	[Ru]1234[O]=C(c5c(cccc5)C)O[Ru]2([O]=C(c2c(cccc2)C)O1)(OC(c1c(cccc1)C)=[O]3)([O]=C(c1c(cccc1)C)O4)[Br][Ru]1234[O]=C(c5c(cccc5)C)O[Ru]2([O]=C(c2c(cccc2)C)O1)(OC(c1c(cccc1)C)=[O]3)([O]=C(c1c(cccc1)C)O4)Br
Title of publication	Synthesis of Ru2Br(mu-O2CC6H4-R)4 (R = o-Me, m-Me, p-Me) Using Microwave Activation: Structural and Magnetic Properties
Authors of publication	Delgado-Martinez, P.; Elvira-Bravo, A.; Gonzalez-Prieto, R.; Priego, J.L.; Jimenez-Aparicio, R.; Torres, M.R.
Journal of publication	Inorganics
Year of publication	2014
Journal volume	2
Pages of publication	524 - 536
a	18.789 ± 0.003 Å
b	13.537 ± 0.0016 Å
c	13.1826 ± 0.0016 Å
α	90°
β	109.175 ± 0.012°
γ	90°
Cell volume	3166.9 ± 0.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0372
Residual factor for significantly intense reflections	0.0266
Weighted residual factors for significantly intense reflections	0.0721
Weighted residual factors for all reflections included in the refinement	0.0804
Goodness-of-fit parameter for all reflections included in the refinement	0.995
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
244950 (current)	2019-12-09	cif/ Adding structures of 1556464 via cif-deposit CGI script.	1556464.cif