Crystallography Open Database

Information card for entry 8105838

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Coordinates	8105838.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H22 N4 O7
Calculated formula	C16 H22 N4 O7
Title of publication	Crystal structure of 3-amino-2-hydroxy-6-methoxybenzamide hydrate, C16H22N4O7
Authors of publication	Gan, Lin Ling; Wang, Bo
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2019
Journal volume	234
Journal issue	4
Pages of publication	747 - 748
a	26.279 ± 0.015 Å
b	30.02 ± 0.017 Å
c	4.404 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	3474 ± 3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	4
Space group number	43
Hermann-Mauguin space group symbol	F d d 2
Hall space group symbol	F 2 -2d
Residual factor for all reflections	0.043
Residual factor for significantly intense reflections	0.0332
Weighted residual factors for significantly intense reflections	0.0835
Weighted residual factors for all reflections included in the refinement	0.0899
Goodness-of-fit parameter for all reflections included in the refinement	1.055
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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