Crystallography Open Database

Information card for entry 2003859

2003858 << 2003859 >> 2003860

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Coordinates	2003859.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	dipotassium bis(2-[[2-[2-[2-[2-(2-hydroxyethoxy)]- phenoxy]ethoxy]phenoxy]ethoxy]methyl]benzoate) trihydrate
Formula	C52 H62 K2 O20
Calculated formula	C52 H52 K2 O24
Title of publication	Potassium Salt of a Synthetic Carboxylic Ionophore
Authors of publication	Kasuga, N. C.; Yamaguchi, K.; Ohashi, Y.
Journal of publication	Acta Crystallographica Section C
Year of publication	1995
Journal volume	51
Journal issue	9
Pages of publication	1816 - 1819
a	17.729 ± 0.011 Å
b	13.521 ± 0.013 Å
c	23.842 ± 0.006 Å
α	90°
β	114.64 ± 0.02°
γ	90°
Cell volume	5195 ± 6 Å³
Cell temperature	296 K
Ambient diffraction temperature	296 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for significantly intense reflections	0.051
Weighted residual factors for significantly intense reflections	0.065
Goodness-of-fit parameter for significantly intense reflections	1.703
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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