Crystallography Open Database

Information card for entry 7201106

7201105 << 7201106 >> 7201107

Preview

Coordinates	7201106.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H24 B3 Cs F12 Fe N10
Calculated formula	C18 H24 B3 Cs F12 Fe N10
Title of publication	Supramolecular assemblies prepared from an iron(II) tripodal complex, tetrafluoroborate, and alkali metal cations. The effect of cation size on coordination number, anion disorder and hydrogen bonding
Authors of publication	Alvarado, Luigi; Brewer, Cynthia; Brewer, Greg; Butcher, Ray J.; Straka, Alison; Viragh, Carol
Journal of publication	CrystEngComm
Year of publication	2009
Journal volume	11
Journal issue	11
Pages of publication	2297
a	13.466 ± 0.0003 Å
b	13.466 ± 0.0003 Å
c	9.4702 ± 0.0002 Å
α	90°
β	90°
γ	120°
Cell volume	1487.19 ± 0.06 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	147
Hermann-Mauguin space group symbol	P -3
Hall space group symbol	-P 3
Residual factor for all reflections	0.0549
Residual factor for significantly intense reflections	0.0361
Weighted residual factors for significantly intense reflections	0.0934
Weighted residual factors for all reflections included in the refinement	0.1095
Goodness-of-fit parameter for all reflections included in the refinement	1.084
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180342 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/11.	7201106.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7201106.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7201106.cif
1167	2010-05-13	cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19.	7201106.cif