Crystallography Open Database

Information card for entry 4513527

Preview

Coordinates	4513527.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H35 Cd3 N4 O14.5
Calculated formula	C46 H34 Cd3 N4 O14.5
Title of publication	Homochiral Cluster-Organic Frameworks Constructed from Enantiopure Lactate Derivatives
Authors of publication	Xu, Zhong-Xuan; Xiao, Yu; Kang, Yao; Zhang, Lei; Zhang, Jian
Journal of publication	Crystal Growth & Design
Year of publication	2015
Journal volume	15
Journal issue	9
Pages of publication	4676
a	9.4565 ± 0.001 Å
b	26.2364 ± 0.0018 Å
c	9.7671 ± 0.001 Å
α	90°
β	117.169 ± 0.014°
γ	90°
Cell volume	2155.9 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0439
Residual factor for significantly intense reflections	0.0411
Weighted residual factors for significantly intense reflections	0.1061
Weighted residual factors for all reflections included in the refinement	0.1084
Goodness-of-fit parameter for all reflections included in the refinement	1.003
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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