Crystallography Open Database

Information card for entry 7015674

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Coordinates	7015674.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H24 Br2 Cd Fe N P
Calculated formula	C28 H24 Br2 Cd Fe N P
Title of publication	The coordination behaviour of ferrocene-based pyridylphosphine ligands towards Zn(II), Cd(II) and Hg(II).
Authors of publication	Siemeling, Ulrich; Klemann, Thorsten; Bruhn, Clemens; Schulz, Jiří; Štěpnička, Petr
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2011
Journal volume	40
Journal issue	17
Pages of publication	4722 - 4740
a	9.1388 ± 0.0011 Å
b	9.5318 ± 0.001 Å
c	16.627 ± 0.0017 Å
α	84.26 ± 0.009°
β	74.946 ± 0.009°
γ	77.441 ± 0.009°
Cell volume	1363.7 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0877
Residual factor for significantly intense reflections	0.0773
Weighted residual factors for significantly intense reflections	0.1969
Weighted residual factors for all reflections included in the refinement	0.2059
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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