Crystallography Open Database

Information card for entry 7055519

Preview

Coordinates	7055519.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36.5 H29.5 N3 O7 Zn
Calculated formula	C36.5 H29.5 N3 O7 Zn
Title of publication	Efficient HPLC enantiomer separation using a pillared homochiral metal‒organic framework as a novel chiral stationary phase
Authors of publication	Tanaka, Koichi; Hotta, Naoki; Nagase, Shohei; Yoza, Kenji
Journal of publication	New J. Chem.
Year of publication	2016
Journal volume	40
Journal issue	6
Pages of publication	4891
a	11.1967 ± 0.0004 Å
b	11.1967 ± 0.0004 Å
c	44.0828 ± 0.0016 Å
α	90°
β	90°
γ	120°
Cell volume	4786.1 ± 0.3 Å³
Cell temperature	273 K
Ambient diffraction temperature	273 K
Number of distinct elements	5
Space group number	179
Hermann-Mauguin space group symbol	P 65 2 2
Hall space group symbol	P 65 2 (0 0 1)
Residual factor for all reflections	0.0271
Residual factor for significantly intense reflections	0.0269
Weighted residual factors for significantly intense reflections	0.073
Weighted residual factors for all reflections included in the refinement	0.0731
Goodness-of-fit parameter for all reflections included in the refinement	1.106
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
183741 (current)	2016-06-18	cif/ Updating files of 7055519, 7055520 Original log message: Adding full bibliography for 7055519--7055520.cif.	7055519.cif
182365	2016-04-28	cif/ Adding structures of 7055519, 7055520 via cif-deposit CGI script.	7055519.cif