Crystallography Open Database

Information card for entry 1512977

Preview

Coordinates	1512977.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H29 N3 O9 Zn2
Calculated formula	C32 H29 N3 O9 Zn2
Title of publication	Syntheses, crystal structures, substituents steric effect, luminescent and moisture-stability studies of three two-dimensional zinc-organic frameworks
Authors of publication	De-Yun Ma; Kuan Lu; Liang Qin; Hai-Fu Guo; Xiong-Yi Peng; Jian-Qiang Liu
Journal of publication	Inorganica Chimica Acta
Year of publication	2013
Journal volume	396
Pages of publication	84 - 91
a	8.458 ± 0.0007 Å
b	21.6474 ± 0.0018 Å
c	9.4309 ± 0.0008 Å
α	90°
β	109.884 ± 0.002°
γ	90°
Cell volume	1623.8 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	11
Hermann-Mauguin space group symbol	P 1 21/m 1
Hall space group symbol	-P 2yb
Residual factor for all reflections	0.0432
Residual factor for significantly intense reflections	0.0352
Weighted residual factors for significantly intense reflections	0.0976
Weighted residual factors for all reflections included in the refinement	0.1029
Goodness-of-fit parameter for all reflections included in the refinement	1.086
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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