Crystallography Open Database

Information card for entry 1543058

Preview

Coordinates	1543058.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H20 F6 K2 N4 O10 S2
Calculated formula	C18 H20 F6 K2 N4 O10 S2
Title of publication	In situ modification of nanostructure configuration through the manipulation of hydrogen bonded amphiphile self-association.
Authors of publication	Hiscock, Jennifer R.; Bustone, Gianluca P.; Wilson, Ben; Belsey, Kate E.; Blackholly, Laura R.
Journal of publication	Soft matter
Year of publication	2016
Journal volume	12
Journal issue	18
Pages of publication	4221
a	9.22908 ± 0.00018 Å
b	7.25364 ± 0.00012 Å
c	38.9707 ± 0.0009 Å
α	90°
β	95.7583 ± 0.0019°
γ	90°
Cell volume	2595.71 ± 0.09 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	7
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	0.0479
Residual factor for significantly intense reflections	0.0418
Weighted residual factors for significantly intense reflections	0.1007
Weighted residual factors for all reflections included in the refinement	0.104
Goodness-of-fit parameter for all reflections included in the refinement	1.103
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
182804 (current)	2016-05-06	cif/ Updating files of 1543057, 1543058 Original log message: Adding full bibliography for 1543057--1543058.cif.	1543058.cif
181983	2016-04-08	cif/ Adding structures of 1543058 via cif-deposit CGI script.	1543058.cif