Crystallography Open Database

Information card for entry 4333303

Preview

Coordinates	4333303.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H26 Cu I O3 S2
Calculated formula	C22 H26 Cu I O3 S2
Title of publication	Calix[4]bis(thiacrown): assembly of an endocyclic disilver(I) complex and exocyclic 3D copper(I) coordination polymers.
Authors of publication	Lee, Jai Young; Lee, So Young; Seo, Joobeom; Park, Chul Soon; Go, Jung Nam; Sim, Wonbo; Lee, Shim Sung
Journal of publication	Inorganic chemistry
Year of publication	2007
Journal volume	46
Journal issue	16
Pages of publication	6221 - 6223
a	11.1221 ± 0.0012 Å
b	16.871 ± 0.0017 Å
c	24.762 ± 0.003 Å
α	90°
β	99.944 ± 0.002°
γ	90°
Cell volume	4576.6 ± 0.9 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1377
Residual factor for significantly intense reflections	0.0577
Weighted residual factors for significantly intense reflections	0.0857
Weighted residual factors for all reflections included in the refinement	0.101
Goodness-of-fit parameter for all reflections included in the refinement	0.95
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179436 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/33.	4333303.cif
116739	2014-06-13	cif/ Updating files of 4333302, 4333303, 4333304 Original log message: Adding full bibliography for 4333302--4333304.cif.	4333303.cif
98918	2014-01-30	cif/ Adding structures of 4333303 via cif-deposit CGI script.	4333303.cif