Crystallography Open Database

Information card for entry 7208200

7208199 << 7208200 >> 7208201

Preview

Coordinates	7208200.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H54 B2 Cd3 F9 N11 O8
Calculated formula	C60 H54 B2 Cd3 F9 N11 O8
Title of publication	The multifunctional roles of the ionic liquid [Bmim][BF4] in the creation of cadmium metal‒organic frameworks
Authors of publication	Xie, Zai-Lai; Feng, Mei-Ling; Tan, Bin; Huang, Xiao-Ying
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	15
Pages of publication	4894
a	22.028 ± 0.006 Å
b	12.607 ± 0.003 Å
c	23.179 ± 0.006 Å
α	90°
β	103.76 ± 0.005°
γ	90°
Cell volume	6252 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0291
Residual factor for significantly intense reflections	0.0269
Weighted residual factors for significantly intense reflections	0.0683
Weighted residual factors for all reflections included in the refinement	0.0703
Goodness-of-fit parameter for all reflections included in the refinement	1.045
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180413 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/82.	7208200.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7208200.cif
64219	2012-08-11	cif/ Adding structures of 7208199, 7208200, 7208201 via cif-deposit CGI script.	7208200.cif