Crystallography Open Database

Information card for entry 4072838

Preview

Coordinates	4072838.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H18 N2 O13.5 Ru7
Calculated formula	C33 H18 N2 O13.5 Ru7
Title of publication	Reactivity of Indene, Fluorene, Azulene, and Acenaphthylene with a Basal-Edge-Bridged Square-Pyramidal Hexaruthenium Dihydride
Authors of publication	Cabeza, Javier A.; del Río, Ignacio; Fernández-Colinas, José M.; García-Álvarez, Pablo; Miguel, Daniel
Journal of publication	Organometallics
Year of publication	2007
Journal volume	26
Journal issue	6
Pages of publication	1414
a	9.978 ± 0.003 Å
b	10.522 ± 0.004 Å
c	19.871 ± 0.007 Å
α	81.9 ± 0.03°
β	79.46 ± 0.03°
γ	71.66 ± 0.03°
Cell volume	1939.1 ± 1.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.0406
Residual factor for significantly intense reflections	0.0342
Weighted residual factors for significantly intense reflections	0.1029
Weighted residual factors for all reflections included in the refinement	0.1119
Goodness-of-fit parameter for all reflections included in the refinement	1.095
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CUKΑ
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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