Crystallography Open Database

Information card for entry 7215954

Preview

Coordinates	7215954.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H16 N4 O9 Zn2
Calculated formula	C16 H16 N4 O9 Zn2
Title of publication	Syntheses, X-ray structures, gas adsorption and luminescent properties of three coordination polymers of Zn(ii) dicarboxylates mixed with a linear, neutral, and rigid N,N′-donor ligand
Authors of publication	Bhattacharya, Biswajit; Saha, Debraj; Maity, Dilip Kumar; Dey, Rajdip; Ghoshal, Debajyoti
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	22
Pages of publication	4783
a	8.5707 ± 0.0011 Å
b	9.8985 ± 0.0012 Å
c	14.2812 ± 0.0017 Å
α	104.986 ± 0.005°
β	102.291 ± 0.005°
γ	91.286 ± 0.005°
Cell volume	1139.7 ± 0.2 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0571
Residual factor for significantly intense reflections	0.0484
Weighted residual factors for significantly intense reflections	0.1722
Weighted residual factors for all reflections included in the refinement	0.1803
Goodness-of-fit parameter for all reflections included in the refinement	1.116
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
180490 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/59.	7215954.cif
113861	2014-05-16	cif/ Adding structures of 7215954, 7215955, 7215956 via cif-deposit CGI script.	7215954.cif