Crystallography Open Database

Information card for entry 7201110

7201109 << 7201110 >> 7201111

Preview

Coordinates	7201110.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H24 B2 F8 Fe N10
Calculated formula	C18 H24 B2 F8 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	9.8471 ± 0.0006 Å
b	22.6507 ± 0.0011 Å
c	12.5484 ± 0.0006 Å
α	90°
β	111.268 ± 0.006°
γ	90°
Cell volume	2608.2 ± 0.3 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1763
Residual factor for significantly intense reflections	0.0453
Weighted residual factors for significantly intense reflections	0.1056
Weighted residual factors for all reflections included in the refinement	0.1283
Goodness-of-fit parameter for all reflections included in the refinement	0.796
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.	7201110.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7201110.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7201110.cif
1167	2010-05-13	cif/ Adding data from the rest of 2009 RSC journals, Inorg-Chem-2008 and Chem-Comm-2010_18-19.	7201110.cif