Crystallography Open Database

Information card for entry 7215092

Preview

Coordinates	7215092.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H17 O7 Pr
Calculated formula	C27 H15 O7 Pr
Title of publication	Ultrasensitive sorption behavior of isostructural lanthanide‒organic frameworks induced by lanthanide contraction
Authors of publication	Lin, Zhongjun; Zou, Ruqiang; Xia, Wei; Chen, Liangjie; Wang, Xidong; Liao, Fuhui; Wang, Yingxia; Lin, Jianhua; Burrell, Anthony K.
Journal of publication	Journal of Materials Chemistry
Year of publication	2012
Journal volume	22
Journal issue	39
Pages of publication	21076
a	16.4393 ± 0.0003 Å
b	16.4393 ± 0.0003 Å
c	23.777 ± 0.0009 Å
α	90°
β	90°
γ	120°
Cell volume	5564.9 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	178
Hermann-Mauguin space group symbol	P 61 2 2
Hall space group symbol	P 61 2 (0 0 5)
Residual factor for all reflections	0.0452
Residual factor for significantly intense reflections	0.0353
Weighted residual factors for significantly intense reflections	0.0899
Weighted residual factors for all reflections included in the refinement	0.0934
Goodness-of-fit parameter for all reflections included in the refinement	0.983
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180481 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/50.	7215092.cif
111073	2014-04-20	cif/ Adding structures of 7215092, 7215093 via cif-deposit CGI script.	7215092.cif