Crystallography Open Database

Information card for entry 4506332

Preview

Coordinates	4506332.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H27 N4 O10 Pr
Calculated formula	C38 H27 N4 O10 Pr
Title of publication	pH and Auxiliary Ligand Influence on the Structural Variations of 5(2′-Carboxylphenyl) Nicotate Coordination Polymers
Authors of publication	Gu, Jinzhong; Gao, Zhuqing; Tang, Yu
Journal of publication	Crystal Growth & Design
Year of publication	2012
Journal volume	12
Journal issue	6
Pages of publication	3312
a	9.173 ± 0.005 Å
b	13.657 ± 0.007 Å
c	14.292 ± 0.007 Å
α	97.179 ± 0.004°
β	96.766 ± 0.005°
γ	104.724 ± 0.004°
Cell volume	1697.1 ± 1.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.0543
Residual factor for significantly intense reflections	0.0426
Weighted residual factors for significantly intense reflections	0.0774
Weighted residual factors for all reflections included in the refinement	0.0812
Goodness-of-fit parameter for all reflections included in the refinement	1.022
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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