Crystallography Open Database

Information card for entry 7233136

Preview

Coordinates	7233136.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H43.87 N2 O8 Zn2
Calculated formula	C38 H43.87 N2 O8 Zn2
Title of publication	Self-assembly of bis-β-diketone-based [M2L2] dinuclear platforms into 2-dimensional coordination polymers
Authors of publication	Brock, A. J.; McMurtrie, John C.; Clegg, J. K.
Journal of publication	CrystEngComm
Year of publication	2019
Journal volume	21
Journal issue	32
Pages of publication	4786
a	16.584 ± 0.003 Å
b	11.077 ± 0.002 Å
c	12.668 ± 0.003 Å
α	90°
β	107.26 ± 0.03°
γ	90°
Cell volume	2222.3 ± 0.9 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1072
Residual factor for significantly intense reflections	0.0851
Weighted residual factors for significantly intense reflections	0.1892
Weighted residual factors for all reflections included in the refinement	0.2078
Goodness-of-fit parameter for all reflections included in the refinement	1.075
Diffraction radiation wavelength	0.7108 Å
Diffraction radiation type	Synchrotron
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
223514 (current)	2019-11-07	cif/ Updating files of 7233133, 7233134, 7233135, 7233136 Original log message: Adding full bibliography for 7233133--7233136.cif.	7233136.cif
217046	2019-07-16	cif/ Adding structures of 7233133, 7233134, 7233135, 7233136 via cif-deposit CGI script.	7233136.cif