Crystallography Open Database

Information card for entry 7247686

Preview

Coordinates	7247686.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H20 Cl4 Mn N2 O6
Calculated formula	C6 H20 Cl4 Mn N2 O6
Title of publication	The odd–even effect in n-carboxyalkylammonium-containing organic–inorganic hybrids of Mn(ii) halides: structural and magnetic characterisation
Authors of publication	Bothma, Shalene N.; Sheppard, Charles J.; Turnbull, Mark M.; Landee, Christopher P.; Rademeyer, Melanie
Journal of publication	CrystEngComm
Year of publication	2023
Journal volume	25
Journal issue	47
Pages of publication	6568 - 6591
a	21.3208 ± 0.0014 Å
b	7.0794 ± 0.0004 Å
c	11.144 ± 0.0006 Å
α	90°
β	107.916 ± 0.002°
γ	90°
Cell volume	1600.49 ± 0.16 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0206
Residual factor for significantly intense reflections	0.0182
Weighted residual factors for significantly intense reflections	0.0458
Weighted residual factors for all reflections included in the refinement	0.0467
Goodness-of-fit parameter for all reflections included in the refinement	1.16
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7247686.html