Crystallography Open Database

Information card for entry 4350739

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Coordinates	4350739.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C184 H156 Cu12 N28 O84
Calculated formula	C184 H156 Cu12 N28 O84
Title of publication	Design and synthesis of nucleobase-incorporated metal‒organic materials
Authors of publication	Zhang, Muwei; Lu, Weigang; Li, Jian-Rong; Bosch, Mathieu; Chen, Ying-Pin; Liu, Tian-Fu; Liu, Yangyang; Zhou, Hong-Cai
Journal of publication	Inorganic Chemistry Frontiers
Year of publication	2014
Journal volume	1
Journal issue	2
Pages of publication	159
a	27.99 ± 0.003 Å
b	28.102 ± 0.003 Å
c	28.303 ± 0.005 Å
α	109.319 ± 0.002°
β	106.426 ± 0.002°
γ	107.182 ± 0.001°
Cell volume	18196 ± 4 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110.15 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1691
Residual factor for significantly intense reflections	0.1014
Weighted residual factors for significantly intense reflections	0.2622
Weighted residual factors for all reflections included in the refinement	0.2841
Goodness-of-fit parameter for all reflections included in the refinement	1.006
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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