Crystallography Open Database

Information card for entry 2237181

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Structure parameters

Chemical name	Anilinium-3-carboxylate 3-carboxyanilinium nitrate
Formula	C14 H15 N3 O7
Calculated formula	C14 H15 N3 O7
Title of publication	Anilinium-3-carboxylate 3-carboxyanilinium nitrate
Authors of publication	Ahmad, Saeed; Hussain, Sajjad; Sharif, Shahzad; Khan, Islam Ullah; Tahir, Muhammad Nawaz
Journal of publication	Acta Crystallographica Section E
Year of publication	2013
Journal volume	69
Journal issue	1
Pages of publication	o29
a	16.0451 ± 0.0003 Å
b	4.7575 ± 0.0001 Å
c	19.7143 ± 0.0004 Å
α	90°
β	107.66 ± 0.001°
γ	90°
Cell volume	1433.96 ± 0.05 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.0406
Residual factor for significantly intense reflections	0.037
Weighted residual factors for significantly intense reflections	0.0981
Weighted residual factors for all reflections included in the refinement	0.1009
Goodness-of-fit parameter for all reflections included in the refinement	1.066
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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