Crystallography Open Database

Information card for entry 7023248

Preview

Coordinates	7023248.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H16 N3 O3 Zn0.5
Calculated formula	C10 H16 N3 O3 Zn0.5
Title of publication	Eight Zn(II) coordination networks based on flexible 1,4-di(1H-imidazol-1-yl)butane and different dicarboxylates: crystal structures, water clusters, and topologies.
Authors of publication	Sun, Di; Xu, Meng-Zhen; Liu, Shan-Shan; Yuan, Shuai; Lu, Hai-Feng; Feng, Sheng-Yu; Sun, Dao-Feng
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	34
Pages of publication	12324 - 12333
a	13.453 ± 0.002 Å
b	11.1544 ± 0.0017 Å
c	16.508 ± 0.003 Å
α	90°
β	99.666 ± 0.003°
γ	90°
Cell volume	2442 ± 0.7 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
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	0.0407
Residual factor for significantly intense reflections	0.0307
Weighted residual factors for significantly intense reflections	0.0797
Weighted residual factors for all reflections included in the refinement	0.0865
Goodness-of-fit parameter for all reflections included in the refinement	1.026
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
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.	7023248.cif
90480	2013-11-17	cif/ Adding structures of 7023248, 7023249, 7023250, 7023251, 7023252, 7023253, 7023254, 7023255 via cif-deposit CGI script.	7023248.cif