Crystallography Open Database

Information card for entry 1560620

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Coordinates	1560620.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C50 H26 Mn N4 O12
Calculated formula	C50 H26 Mn N4 O12
Title of publication	Cationic Mn 2+ /H + exchange leading a slow solid-state transformation of a 2D porphyrinic network at ambient conditions
Authors of publication	Amayuelas, Eder; Fidalgo-Marijuan, Arkaitz; Bazán, Begoña; Urtiaga, Miren Karmele; Barandika, Gotzone; Lezama, Luis; Arriortua, María Isabel
Journal of publication	Journal of Solid State Chemistry
Year of publication	2017
Journal volume	247
Pages of publication	161 - 167
a	22.3102 ± 0.0004 Å
b	22.3102 ± 0.0004 Å
c	12.0095 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	5977.7 ± 0.2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100.15 K
Number of distinct elements	5
Space group number	125
Hermann-Mauguin space group symbol	P 4/n b m :2
Hall space group symbol	-P 4a 2b
Residual factor for all reflections	0.1129
Residual factor for significantly intense reflections	0.0864
Weighted residual factors for significantly intense reflections	0.2748
Weighted residual factors for all reflections included in the refinement	0.3017
Goodness-of-fit parameter for all reflections included in the refinement	1.099
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
262195 (current)	2021-02-24	cif/ Adding structures of 1560619, 1560620 via cif-deposit CGI script.	1560620.cif