Crystallography Open Database

Information card for entry 4504111

Preview

Coordinates	4504111.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C2 H10 F3 In N2 O3 Se
Calculated formula	C2 H10 F3 In N2 O3 Se
Title of publication	New Organically Templated Gallium and Indium Selenites or Selenates with One-, Two-, and Three-Dimensional Structures
Authors of publication	Feng, Mei-Ling; Li, Xiu-Ling; Mao, Jiang-Gao
Journal of publication	Crystal Growth & Design
Year of publication	2007
Journal volume	7
Journal issue	4
Pages of publication	770
a	9.3066 ± 0.0005 Å
b	8.3012 ± 0.0005 Å
c	11.2923 ± 0.0007 Å
α	90°
β	92.329 ± 0.004°
γ	90°
Cell volume	871.68 ± 0.09 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0275
Residual factor for significantly intense reflections	0.0239
Weighted residual factors for significantly intense reflections	0.05
Weighted residual factors for all reflections included in the refinement	0.0513
Goodness-of-fit parameter for all reflections included in the refinement	1.098
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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