Crystallography Open Database

Information card for entry 1518559

Preview

Coordinates	1518559.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C7 H5 I K O2.5
Calculated formula	C7 H4 I K O2.5
Title of publication	Mesophases and Ionic Conductivities of Simple Organic Salts of M(m-Iodobenzoate) (M = Li(+), Na(+), K(+), Rb(+), and Cs(+)).
Authors of publication	Endo, Manami; Nakane, Yuta; Takahashi, Kiyonori; Hoshino, Norihisa; Takeda, Takashi; Noro, Shin-Ichiro; Nakamura, Takayoshi; Akutagawa, Tomoyuki
Journal of publication	The journal of physical chemistry. B
Year of publication	2015
Journal volume	119
Journal issue	4
Pages of publication	1768 - 1777
a	6.3689 Å
b	7.4984 Å
c	18.6977 Å
α	83.832°
β	83.446°
γ	84.606°
Cell volume	878.942 Å³
Cell temperature	123 K
Ambient diffraction temperature	123 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.086
Residual factor for significantly intense reflections	0.0709
Weighted residual factors for significantly intense reflections	0.1843
Weighted residual factors for all reflections included in the refinement	0.1974
Goodness-of-fit parameter for all reflections included in the refinement	1.071
Diffraction radiation wavelength	1.54187 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1518559.cif
130754	2015-02-04	cif/ Updating files of 1518557, 1518558, 1518559, 1518560, 1518561 Original log message: Adding full bibliography for 1518557--1518561.cif.	1518559.cif
129923	2015-01-17	cif/ Adding structures of 1518557, 1518558, 1518559, 1518560, 1518561 via cif-deposit CGI script.	1518559.cif