Crystallography Open Database

Information card for entry 7052867

Preview

Coordinates	7052867.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C88 H140 Cs2 F12 O14 P2
Calculated formula	C88 H140 Cs2 F12 O14 P2
Title of publication	Cation binding resorcinarene bis-crowns: the effect of lower rim alkyl chain length on crystal packing and solid lipid nanoparticles
Authors of publication	Helttunen, Kaisa; Salorinne, Kirsi; Barboza, Tahnie; Barbosa, Hélène Campos; Suhonen, Aku; Nissinen, Maija
Journal of publication	New Journal of Chemistry
Year of publication	2012
Journal volume	36
Journal issue	3
Pages of publication	789
a	10.4675 ± 0.0004 Å
b	16.8329 ± 0.0007 Å
c	27.588 ± 0.001 Å
α	96.549 ± 0.002°
β	97.404 ± 0.002°
γ	93.961 ± 0.002°
Cell volume	4771.6 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1581
Residual factor for significantly intense reflections	0.0824
Weighted residual factors for significantly intense reflections	0.1649
Weighted residual factors for all reflections included in the refinement	0.2038
Goodness-of-fit parameter for all reflections included in the refinement	1.056
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180082 (current)	2016-03-26	cif/7/05/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/05/28.	7052867.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7052867.cif
37723	2012-03-04	../uploads/cif-deposit/cod/cif Adding structures of 7052862, 7052863, 7052864, 7052865, 7052866, 7052867 via cif-deposit CGI script.	7052867.cif