Crystallography Open Database

Information card for entry 7112945

Preview

Coordinates	7112945.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H36 F8 N10 O17 Zn2
Calculated formula	C56 H36 F8 N10 O17 Zn2
Title of publication	Unique Zn(II) coordination entanglement networks with a flexible fluorinated bis-pyridinecarboxamide tecton and benzenedicarboxylates.
Authors of publication	Zhang, Zhi-Hui; Chen, Sheng-Chun; Mi, Jin-Ling; He, Ming-Yang; Chen, Qun; Du, Miao
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2010
Journal volume	46
Journal issue	44
Pages of publication	8427 - 8429
a	11.738 ± 0.002 Å
b	16.567 ± 0.003 Å
c	16.799 ± 0.003 Å
α	73.42 ± 0.002°
β	70.116 ± 0.002°
γ	85.726 ± 0.002°
Cell volume	2943.4 ± 0.9 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0807
Residual factor for significantly intense reflections	0.0509
Weighted residual factors for significantly intense reflections	0.1338
Weighted residual factors for all reflections included in the refinement	0.1597
Goodness-of-fit parameter for all reflections included in the refinement	1.08
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
180243 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/29.	7112945.cif
112175	2014-04-30	cif/ Adding structures of 7112942, 7112943, 7112944, 7112945 via cif-deposit CGI script.	7112945.cif