Crystallography Open Database

Information card for entry 7116185

Preview

Coordinates	7116185.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C155 H112 Cd4 N12 O19
Calculated formula	C155 H112 Cd4 N12 O19
Title of publication	One non-interpenetrated chiral porous multifunctional metal-organic framework and its applications for sensing small solvent molecules and adsorption.
Authors of publication	Qin, Ling; Zheng, Meng-Xi; Guo, Zi-Jian; Zheng, He-Gen; Xu, Yan
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2015
Journal volume	51
Journal issue	12
Pages of publication	2447 - 2449
a	28.95 ± 0.002 Å
b	39.508 ± 0.003 Å
c	10.2785 ± 0.0008 Å
α	90°
β	95.737 ± 0.001°
γ	90°
Cell volume	11697.2 ± 1.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0422
Residual factor for significantly intense reflections	0.0375
Weighted residual factors for significantly intense reflections	0.0977
Weighted residual factors for all reflections included in the refinement	0.1
Goodness-of-fit parameter for all reflections included in the refinement	1.09
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	7116185.cif
130915	2015-02-04	cif/ Updating files of 7116185 Original log message: Adding full bibliography for 7116185.cif.	7116185.cif
129287	2015-01-01	cif/ Adding structures of 7116185 via cif-deposit CGI script.	7116185.cif