Crystallography Open Database

Information card for entry 7703832

Preview

Coordinates	7703832.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H33 N2 O12.5 Zn
Calculated formula	C23 H33 N2 O12.5 Zn
Title of publication	Coordination polymers of a bis-isophthalate bridging ligand with single molecule magnet behaviour of the Co<sup>II</sup> analogue.
Authors of publication	Chahine, Ali Y.; Phonsri, Wasinee; Murray, Keith S.; Turner, David R.; Batten, Stuart R.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	16
Pages of publication	5241 - 5249
a	19.8716 ± 0.0004 Å
b	9.3173 ± 0.0002 Å
c	14.114 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	2613.2 ± 0.11 Å³
Cell temperature	123 ± 0.13 K
Ambient diffraction temperature	123 ± 0.13 K
Number of distinct elements	5
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.0671
Residual factor for significantly intense reflections	0.0586
Weighted residual factors for significantly intense reflections	0.1481
Weighted residual factors for all reflections included in the refinement	0.1551
Goodness-of-fit parameter for all reflections included in the refinement	1.091
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
251622 (current)	2020-05-05	cif/ Updating files of 7703831, 7703832, 7703833, 7703834 Original log message: Adding full bibliography for 7703831--7703834.cif.	7703832.cif
249645	2020-03-24	cif/ Adding structures of 7703831, 7703832, 7703833, 7703834 via cif-deposit CGI script.	7703832.cif