Crystallography Open Database

Information card for entry 4508453

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Coordinates	4508453.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H14 Ce N9 O11
Calculated formula	C14 H14 Ce N9 O11
Title of publication	Syntheses and Properties of One‒Three-Dimensional Coordination Polymers Constructed by Metallohelicates of Purin-Containing Carboxylate
Authors of publication	Yuan, Xiaoju; Zhang, Xiaoxia; Zhao, Hong; Liu, Lina; Wu, Benlai
Journal of publication	Crystal Growth & Design
Year of publication	2013
Journal volume	13
Journal issue	11
Pages of publication	4859
a	7.5429 ± 0.0005 Å
b	15.1009 ± 0.0008 Å
c	9.1529 ± 0.0005 Å
α	90°
β	104.527 ± 0.006°
γ	90°
Cell volume	1009.23 ± 0.11 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	5
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0332
Residual factor for significantly intense reflections	0.0293
Weighted residual factors for significantly intense reflections	0.0597
Weighted residual factors for all reflections included in the refinement	0.0618
Goodness-of-fit parameter for all reflections included in the refinement	1.018
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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