Crystallography Open Database

Information card for entry 4131404

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Coordinates	4131404.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H31 B F15 Fe
Calculated formula	C38 H31 B F15 Fe
Title of publication	Single Electron Delivery to Lewis Pairs: An Avenue to Anions by Small Molecule Activation.
Authors of publication	Liu, Liu Leo; Cao, Levy L.; Shao, Yue; Stephan, Douglas W.
Journal of publication	Journal of the American Chemical Society
Year of publication	2017
Journal volume	139
Journal issue	29
Pages of publication	10062 - 10071
a	35.462 ± 0.003 Å
b	10.0966 ± 0.0007 Å
c	20.1865 ± 0.0012 Å
α	90°
β	102.362 ± 0.005°
γ	90°
Cell volume	7060.1 ± 0.9 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.1279
Residual factor for significantly intense reflections	0.0509
Weighted residual factors for significantly intense reflections	0.0872
Weighted residual factors for all reflections included in the refinement	0.1191
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

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