Crystallography Open Database

Information card for entry 1571428

Preview

Coordinates	1571428.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H46 Cl4 Mg N6 O6
Calculated formula	C42 H46 Cl4 Mg N6 O6
Title of publication	Therapeutic coordination polymers: tailoring drug release through metal-ligand interactions.
Authors of publication	Murphy, Jennifer N.; Kobti, Joy-Lynn; Dao, Michelle; Wear, Darcy; Okoko, Michael; Pandey, Siyaram; Vukotic, V. Nicholas
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	19
Pages of publication	7041 - 7050
a	8.4844 ± 0.0001 Å
b	20.9466 ± 0.0002 Å
c	12.8419 ± 0.0001 Å
α	90°
β	107.427 ± 0.001°
γ	90°
Cell volume	2177.5 ± 0.04 Å³
Cell temperature	170 K
Ambient diffraction temperature	170 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0463
Residual factor for significantly intense reflections	0.0431
Weighted residual factors for significantly intense reflections	0.1135
Weighted residual factors for all reflections included in the refinement	0.1169
Goodness-of-fit parameter for all reflections included in the refinement	1.072
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
292886 (current)	2024-07-05	cif/ Updating files of 1571426, 1571427, 1571428, 1571429, 1571430, 1571431, 1571432, 1571433, 1571434, 1571435, 1571436 Original log message: Adding full bibliography for 1571426--1571436.cif.	1571428.cif
291200	2024-04-16	cif/ Adding structures of 1571426, 1571427, 1571428, 1571429, 1571430, 1571431, 1571432, 1571433, 1571434, 1571435, 1571436 via cif-deposit CGI script.	1571428.cif