Crystallography Open Database

Information card for entry 2010180

2010179 << 2010180 >> 2010181

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Coordinates	2010180.cif
Original IUCr paper	HTML

Structure parameters

Formula	C16 H19 Br N2 O4
Calculated formula	C16 H19 Br N2 O4
Title of publication	Bis(pyridiniopropionate) hydrogen bromide
Authors of publication	Chen, X.-M.; Mak, T.C.W.
Journal of publication	Acta Crystallographica Section C
Year of publication	1994
Journal volume	50
Journal issue	11
Pages of publication	1807 - 1809
a	32.108 ± 0.006 Å
b	9.244 ± 0.002 Å
c	12.043 ± 0.003 Å
α	90°
β	103.63 ± 0.02°
γ	90°
Cell volume	3473.8 ± 1.3 Å³
Cell temperature	295 K
Number of distinct elements	5
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for significantly intense reflections	0.061
Weighted residual factors for significantly intense reflections	0.076
Goodness-of-fit parameter for significantly intense reflections	1.35
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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