Crystallography Open Database

Information card for entry 7218039

Preview

Coordinates	7218039.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C206 H250 Mn9 N4 O94
Calculated formula	C206 H206 Mn9 N4 O94
Title of publication	Three resorcin[4]arene-based complexes with Cu(ii)-exchange characteristics and fluorescence sensing of polyoxometalates in aqueous solutions
Authors of publication	Jiang, Wei; Zhang, Hang; Yang, Jin; Liu, Ying-Ying; Liu, Hai-Yan; Ma, Jian-Fang
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	41
Pages of publication	9638
a	11.8811 ± 0.0006 Å
b	20.9902 ± 0.0014 Å
c	21.3711 ± 0.0011 Å
α	79.558 ± 0.005°
β	81.534 ± 0.004°
γ	86.36 ± 0.005°
Cell volume	5180.6 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.2061
Residual factor for significantly intense reflections	0.0962
Weighted residual factors for significantly intense reflections	0.2144
Weighted residual factors for all reflections included in the refinement	0.2808
Goodness-of-fit parameter for all reflections included in the refinement	1.025
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7218039.html