Crystallography Open Database

Information card for entry 2004171

2004170 << 2004171 >> 2004172

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Coordinates	2004171.cif
Original IUCr paper	HTML

Structure parameters

Formula	C14 H18 N8 O7
Calculated formula	C14 H18 N8 O7
Title of publication	5-(2,4-Dihydroxyphenyl)tetrazole Sesquihydrate
Authors of publication	Gallardo, H.; Meyer, E.; Vencato, I.
Journal of publication	Acta Crystallographica Section C
Year of publication	1995
Journal volume	51
Journal issue	11
Pages of publication	2430 - 2432
a	6.908 ± 0.006 Å
b	9.662 ± 0.001 Å
c	14.012 ± 0.002 Å
α	84.53 ± 0.01°
β	74.5 ± 0.03°
γ	86.98 ± 0.03°
Cell volume	896.8 ± 0.8 Å³
Cell temperature	295 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.0468
Weighted residual factors for significantly intense reflections	0.06
Goodness-of-fit parameter for significantly intense reflections	0.75
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	Mo
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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