Crystallography Open Database

Information card for entry 7205739

7205738 << 7205739 >> 7205740

Preview

Coordinates	7205739.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H32 N4 O11 S Zn
Calculated formula	C24 H24 N4 O11 S Zn
Title of publication	Topological diversity in zinc coordination polymers with 5-substituted isophthalate and bis(4-pyridylmethyl)piperazine ligands
Authors of publication	Pochodylo, Amy L.; LaDuca, Robert L.
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	7
Pages of publication	2249
a	9.8561 ± 0.0007 Å
b	11.9538 ± 0.0009 Å
c	22.8463 ± 0.0016 Å
α	90°
β	95.506 ± 0.001°
γ	90°
Cell volume	2679.3 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
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	0.0498
Residual factor for significantly intense reflections	0.0462
Weighted residual factors for significantly intense reflections	0.132
Weighted residual factors for all reflections included in the refinement	0.1356
Goodness-of-fit parameter for all reflections included in the refinement	1.096
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180388 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/57.	7205739.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7205739.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7205739.cif
20999	2011-06-21	../uploads/cif-deposit/cod/cif Adding structures of 7205734, 7205735, 7205736, 7205737, 7205738, 7205739 via cif-deposit CGI script.	7205739.cif