Crystallography Open Database

Information card for entry 2214218

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Original IUCr paper	HTML

Structure parameters

Chemical name	Diaquabis(quinoline-2-carboxylato-κ^2^N,O)magnesium(II) dihydrate methanol disolvate
Formula	C22 H28 Mg N2 O10
Calculated formula	C22 H28 Mg N2 O10
SMILES	c12ccccc1ccc([n]21)C(=O)O[Mg]12(OC(=O)c1ccc3c(cccc3)[n]12)([OH2])[OH2].O.OC.O.OC
Title of publication	Diaquabis(quinoline-2-carboxylato-κ^2^<i>N</i>,<i>O</i>)magnesium(II) dihydrate methanol disolvate
Authors of publication	Xi-Shi Tai; Jie Yin; Ming-Yang Hao
Journal of publication	Acta Crystallographica Section E
Year of publication	2007
Journal volume	63
Journal issue	7
Pages of publication	m1850 - m1850
a	7.129 ± 0.003 Å
b	9.038 ± 0.003 Å
c	10.846 ± 0.004 Å
α	75.677 ± 0.005°
β	74.138 ± 0.005°
γ	70.16 ± 0.005°
Cell volume	623 ± 0.4 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 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	0.0913
Residual factor for significantly intense reflections	0.0637
Weighted residual factors for significantly intense reflections	0.1225
Weighted residual factors for all reflections included in the refinement	0.1289
Goodness-of-fit parameter for all reflections included in the refinement	1.087
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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