Crystallography Open Database

Information card for entry 2200025

2200024 << 2200025 >> 2200026

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Coordinates	Coordinates are not available: file is not found.
Structure factors	2200025.hkl
Original IUCr paper	HTML

Structure parameters

Chemical name	Bis(2-hydroxyethylammonium) oxalate
Formula	C6 H16 N2 O6
Calculated formula	C6 H16 N2 O6
SMILES	C(O)C[NH3+].C(=O)([O-])C(=O)[O-].C(CO)[NH3+]
Title of publication	Bis(2-hydroxyethylammonium) oxalate
Authors of publication	Jordanovska, Vera; Naumov, Pancě; Kim, Moon-Jib; Lee, Han-Jun; Ng, Seik Weng
Journal of publication	Acta Crystallographica Section E
Year of publication	2001
Journal volume	57
Journal issue	1
Pages of publication	o45 - o47
a	17.473 ± 0.005 Å
b	5.916 ± 0.002 Å
c	10.346 ± 0.003 Å
α	90°
β	118.69 ± 0.02°
γ	90°
Cell volume	938.2 ± 0.5 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.089
Residual factor for significantly intense reflections	0.041
Weighted residual factors for all reflections included in the refinement	0.114
Goodness-of-fit parameter for all reflections included in the refinement	1.01
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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