Crystallography Open Database

Information card for entry 7215318

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Coordinates	7215318.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H22 N6 O7 Zn
Calculated formula	C16 H18 N6 O7 Zn
Title of publication	A polythreading coordination array formed from 2D grid networks and 1D chains
Authors of publication	Wang, Ju; Zhu, Xia; Cui, Yan-Feng; Li, Bao-Long; Li, Hai-Yan
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	10
Pages of publication	3342
a	10.3742 ± 0.0003 Å
b	10.9261 ± 0.0005 Å
c	11.5914 ± 0.0011 Å
α	68.78 ± 0.03°
β	65.22 ± 0.02°
γ	62.77 ± 0.02°
Cell volume	1036.9 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.126
Residual factor for significantly intense reflections	0.0717
Weighted residual factors for significantly intense reflections	0.1868
Weighted residual factors for all reflections included in the refinement	0.2686
Goodness-of-fit parameter for all reflections included in the refinement	1.07
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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