Crystallography Open Database

Information card for entry 7713413

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Coordinates	7713413.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C4 H14 Mg N2 O10 P2
Calculated formula	C4 H14 Mg N2 O10 P2
Title of publication	Solvent-free synthesis of magnesium phosphite-oxalates showing second-harmonic generation responses
Authors of publication	Luo, Lisiteng; Wen, Xuemei; Cheng, Juan; Li, Jing; Zeng, Hongmei; Zou, Guohong; Lin, Zhien
Journal of publication	Dalton Transactions
Year of publication	2023
a	7.3313 ± 0.0002 Å
b	9.0913 ± 0.0002 Å
c	8.7803 ± 0.0002 Å
α	90°
β	93.714 ± 0.002°
γ	90°
Cell volume	583.99 ± 0.02 Å³
Cell temperature	292.9 ± 0.2 K
Ambient diffraction temperature	292.9 ± 0.2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0458
Residual factor for significantly intense reflections	0.0452
Weighted residual factors for significantly intense reflections	0.1168
Weighted residual factors for all reflections included in the refinement	0.1184
Goodness-of-fit parameter for all reflections included in the refinement	1.091
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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