Crystallography Open Database

Information card for entry 2021257

2021256 << 2021257 >> 2021258

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Structure parameters

Chemical name	Pentakis(tetraethylammonium) azidododecavanadate nitromethane monosolvate
Formula	C41 H103 N9 O34 V12
Calculated formula	C41 H103 N9 O34 V12
Title of publication	Synthesis and structural characterization of tube-type tetradecavanadates
Authors of publication	Kuwajima, Sho; Arai, Yuta; Kitajima, Hiromasa; Kikukawa, Yuji; Hayashi, Yoshihito
Journal of publication	Acta Crystallographica Section C
Year of publication	2018
Journal volume	74
Journal issue	11
a	26.3672 ± 0.0011 Å
b	13.0801 ± 0.0005 Å
c	20.6502 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	7122 ± 0.5 Å³
Cell temperature	83 ± 2 K
Ambient diffraction temperature	83 ± 2 K
Number of distinct elements	5
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.04
Residual factor for significantly intense reflections	0.0368
Weighted residual factors for significantly intense reflections	0.0854
Weighted residual factors for all reflections included in the refinement	0.0882
Goodness-of-fit parameter for all reflections included in the refinement	1.122
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	Yes

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