Crystallography Open Database

Information card for entry 7026260

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Coordinates	7026260.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C2 H16 Al B5 N2 O12
Calculated formula	C2 H16 Al B5 N2 O12
Title of publication	Two additive-induced isomeric aluminoborates templated by methylamine.
Authors of publication	Cao, Gao-Juan; Lin, Jian; Wang, Jin-Yun; Zheng, Shou-Tian; Fang, Wei-Hui; Yang, Guo-Yu
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	37
Pages of publication	8631 - 8636
a	10.9744 ± 0.0018 Å
b	10.9744 ± 0.0018 Å
c	23.216 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	2796.1 ± 1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	122
Hermann-Mauguin space group symbol	I -4 2 d
Hall space group symbol	I -4 2bw
Residual factor for all reflections	0.0354
Residual factor for significantly intense reflections	0.0313
Weighted residual factors for significantly intense reflections	0.0842
Weighted residual factors for all reflections included in the refinement	0.1036
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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