Crystallography Open Database

Information card for entry 7023664

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Coordinates	7023664.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H16 N2 O6 Zn
Calculated formula	C17 H16 N2 O6 Zn
Title of publication	CO2 selective dynamic two-dimensional Zn(II) coordination polymer.
Authors of publication	Hwang, In Hong; Bae, Jeong Mi; Hwang, Yong-Kyung; Kim, Ha-Yeong; Kim, Cheal; Huh, Seong; Kim, Sung-Jin; Kim, Youngmee
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	44
Pages of publication	15645 - 15649
a	8.046 ± 0.0016 Å
b	5.793 ± 0.0012 Å
c	19.177 ± 0.004 Å
α	90°
β	97.46 ± 0.03°
γ	90°
Cell volume	886.3 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.0347
Residual factor for significantly intense reflections	0.0321
Weighted residual factors for significantly intense reflections	0.0963
Weighted residual factors for all reflections included in the refinement	0.0974
Goodness-of-fit parameter for all reflections included in the refinement	1.123
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
179941 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/36.	7023664.cif
90600	2013-11-18	cif/ Adding structures of 7023664 via cif-deposit CGI script.	7023664.cif