Crystallography Open Database

Information card for entry 7052970

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Coordinates	7052970.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H20 N2 O12
Calculated formula	C8 H16 N2 O12
Title of publication	From 3D channelled frameworks to 2D layered structures in molecular salts of l-serine and dl-serine with oxalic acid
Authors of publication	Braga, Dario; Chelazzi, Laura; Ciabatti, Iacopo; Grepioni, Fabrizia
Journal of publication	New Journal of Chemistry
Year of publication	2013
Journal volume	37
Journal issue	1
Pages of publication	97
a	4.8685 ± 0.0003 Å
b	17.2207 ± 0.0012 Å
c	17.2062 ± 0.0015 Å
α	90°
β	91.668 ± 0.007°
γ	90°
Cell volume	1441.94 ± 0.18 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1464
Residual factor for significantly intense reflections	0.1065
Weighted residual factors for significantly intense reflections	0.2271
Weighted residual factors for all reflections included in the refinement	0.2465
Goodness-of-fit parameter for all reflections included in the refinement	1.255
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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