Crystallography Open Database

Information card for entry 4517002

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Coordinates	4517002.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C173 H226 Cu4 N12 O31
Calculated formula	C173 H226 Cu4 N12 O31
Title of publication	Sub-Picomolar Recognition of Cr3+ through Bioinspired Organic‒Inorganic Ensemble Utilization
Authors of publication	Dey, Gourab; Venkateswarulu, Mangili; Vivekananthan, Venkateswaran; Pramanik, Avijit; Krishnan, Venkata; Koner, Rik Rani
Journal of publication	ACS Sensors
Year of publication	2016
Journal volume	1
Journal issue	6
Pages of publication	663
a	31.769 ± 0.0009 Å
b	8.9771 ± 0.0002 Å
c	32.5469 ± 0.001 Å
α	90°
β	110.34 ± 0.003°
γ	90°
Cell volume	8703.4 ± 0.4 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.098
Residual factor for significantly intense reflections	0.091
Weighted residual factors for significantly intense reflections	0.3327
Weighted residual factors for all reflections included in the refinement	0.3408
Goodness-of-fit parameter for all reflections included in the refinement	1.093
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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