Crystallography Open Database

Information card for entry 7705326

Preview

Coordinates	7705326.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72 H74 Cl2 Mn N10 O14
Calculated formula	C72 H74 Cl2 Mn N10 O14
Title of publication	Tuneable solvent adsorption and exchange by 1D bispidine-based Mn(II) coordination polymers <i>via</i> ligand design.
Authors of publication	Lippi, Martina; Caputo, Josefina; Meneghetti, Fiorella; Castellano, Carlo; Martí-Rujas, Javier; Cametti, Massimo
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	38
Pages of publication	13420 - 13429
a	12.34 ± 0.03 Å
b	22.76 ± 0.07 Å
c	11.13 ± 0.02 Å
α	90°
β	106.49 ± 0.14°
γ	90°
Cell volume	2997 ± 13 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
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	0.0931
Residual factor for significantly intense reflections	0.0778
Weighted residual factors for significantly intense reflections	0.2327
Weighted residual factors for all reflections included in the refinement	0.2482
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
258872 (current)	2020-11-06	cif/ Updating files of 7705323, 7705324, 7705325, 7705326, 7705327 Original log message: Adding full bibliography for 7705323--7705327.cif.	7705326.cif
255771	2020-09-01	cif/ Adding structures of 7705323, 7705324, 7705325, 7705326, 7705327 via cif-deposit CGI script.	7705326.cif