Crystallography Open Database

Information card for entry 7209925

7209924 << 7209925 >> 7209926

Preview

Coordinates	7209925.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H18 Ce2 O47 S12
Calculated formula	C36 H18 Ce2 O47 S12
Title of publication	Supramolecular assemblies with water-soluble p-sulfonatothiacalix[6]arene lanthanide complexes: one-dimensional ‘ladder-type’ coordination polymers and one-dimensional hydrogen-bonded polymers
Authors of publication	Yamada, Manabu; Hamada, Fumio
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	28
Pages of publication	5703
a	13.916 ± 0.0008 Å
b	26.5308 ± 0.0013 Å
c	19.3049 ± 0.0011 Å
α	90°
β	90°
γ	90°
Cell volume	7127.4 ± 0.7 Å³
Cell temperature	110.1 K
Ambient diffraction temperature	110.1 K
Number of distinct elements	5
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for significantly intense reflections	0.0722
Weighted residual factors for all reflections included in the refinement	0.2427
Goodness-of-fit parameter for all reflections included in the refinement	1.126
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7209925.cif
86880	2013-07-12	cif/ Adding structures of 7209924, 7209925, 7209926, 7209927, 7209928, 7209929, 7209930 via cif-deposit CGI script.	7209925.cif