Crystallography Open Database

Information card for entry 7034475

Preview

Coordinates	7034475.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H64.5 Cd3 N6.5 O16.5
Calculated formula	C60 H64.5 Cd3 N6.5 O16.5
Title of publication	A 2D bilayered metal-organic framework as a fluorescent sensor for highly selective sensing of nitro explosives.
Authors of publication	Hu, Xiao-Li; Liu, Fu-Hong; Qin, Chao; Shao, Kui-Zhan; Su, Zhong-Min
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	17
Pages of publication	7822 - 7827
a	13.53 ± 0.005 Å
b	14.255 ± 0.005 Å
c	19.655 ± 0.005 Å
α	73.034 ± 0.005°
β	74.572 ± 0.005°
γ	62.256 ± 0.005°
Cell volume	3170.9 ± 1.8 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 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	0.0826
Residual factor for significantly intense reflections	0.0534
Weighted residual factors for significantly intense reflections	0.1386
Weighted residual factors for all reflections included in the refinement	0.1574
Goodness-of-fit parameter for all reflections included in the refinement	1.019
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7034475.cif
138739	2015-06-07	cif/ Updating files of 7034475 Original log message: Adding full bibliography for 7034475.cif.	7034475.cif
134170	2015-03-20	cif/ Adding structures of 7034475 via cif-deposit CGI script.	7034475.cif