Crystallography Open Database

Information card for entry 4120334

4120333 << 4120334 >> 4120335

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Coordinates	4120334.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H17 B7 Fe
Calculated formula	C10 H17 B7 Fe
Title of publication	Syntheses and Structural Characterizations of Inorganic ansa-Metallocene Analogues: ansa-Ferratricarbadecaboranes
Authors of publication	Brendan Gleeson; Patrick J. Carroll; Larry G. Sneddon
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	12407 - 12413
a	6.5321 ± 0.0003 Å
b	8.0627 ± 0.0003 Å
c	12.6859 ± 0.0005 Å
α	73.519 ± 0.002°
β	84.233 ± 0.002°
γ	77.446 ± 0.002°
Cell volume	624.81 ± 0.05 Å³
Cell temperature	143 ± 1 K
Ambient diffraction temperature	143 ± 1 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0283
Residual factor for significantly intense reflections	0.0236
Weighted residual factors for significantly intense reflections	0.0707
Weighted residual factors for all reflections included in the refinement	0.0827
Goodness-of-fit parameter for all reflections included in the refinement	1.231
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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