Crystallography Open Database

Information card for entry 2239119

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Structure parameters

Chemical name	1-(Bromomercurio)ferrocene
Formula	C10 H9 Br Fe Hg
Calculated formula	C10 H9 Br Fe Hg
Title of publication	1-(Bromomercurio)ferrocene
Authors of publication	Breunig, Jens M.; Lerner, Hans-Wolfram; Bats, Jan W.
Journal of publication	Acta Crystallographica Section E
Year of publication	2014
Journal volume	70
Journal issue	1
Pages of publication	m13
a	7.6484 ± 0.0014 Å
b	9.5715 ± 0.0017 Å
c	14.394 ± 0.003 Å
α	75.12 ± 0.012°
β	87.548 ± 0.012°
γ	83.298 ± 0.012°
Cell volume	1011.4 ± 0.3 Å³
Cell temperature	166 ± 2 K
Ambient diffraction temperature	166 ± 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	0.0449
Residual factor for significantly intense reflections	0.0349
Weighted residual factors for significantly intense reflections	0.0839
Weighted residual factors for all reflections included in the refinement	0.0907
Goodness-of-fit parameter for all reflections included in the refinement	1.095
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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