Crystallography Open Database

Information card for entry 7708701

Preview

Coordinates	7708701.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11.5 H15.5 N O4.5 Ru
Calculated formula	C11.5 H15.5 N O4.5 Ru
Title of publication	Structural and electronic forms of doubly oxido/Pz and triply oxido/(Pz)2 bridged mixed valent and isovalent diruthenium complexes (Pz=Pyrazolate)
Authors of publication	Lahiri, Goutam Kumar; Bera, Sudip Kumar
Journal of publication	Dalton Transactions
Year of publication	2021
a	11.5517 ± 0.0003 Å
b	16.3753 ± 0.0004 Å
c	14.4599 ± 0.0005 Å
α	90°
β	97.099 ± 0.003°
γ	90°
Cell volume	2714.3 ± 0.14 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	I 1 2/a 1
Hall space group symbol	-I 2ya
Residual factor for all reflections	0.0242
Residual factor for significantly intense reflections	0.02
Weighted residual factors for significantly intense reflections	0.0492
Weighted residual factors for all reflections included in the refinement	0.0502
Goodness-of-fit parameter for all reflections included in the refinement	1.09
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

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