Crystallography Open Database

Information card for entry 7017078

Preview

Coordinates	7017078.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	MnMn(bpy) Hofmann
Chemical name	{[Mn(H~2~O)(bpy)~0.5~][Mn(N)(CN)~4~(bpy)~0.5~] .2H~2~O
Formula	C14 H8 Mn2 N7 O3
Calculated formula	C14 H8 Mn2 N7 O3
Title of publication	A new modification of an old framework: Hofmann layers with unusual tetracyanidometallate groups.
Authors of publication	Keene, Tony D.; Murphy, Michael J.; Price, Jason R.; Price, David J.; Kepert, Cameron J.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2011
Journal volume	40
Journal issue	43
Pages of publication	11621 - 11628
a	7.362 ± 0.0015 Å
b	18.015 ± 0.004 Å
c	13.908 ± 0.003 Å
α	90°
β	90.52 ± 0.03°
γ	90°
Cell volume	1844.5 ± 0.7 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	5
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	0.081
Residual factor for significantly intense reflections	0.0809
Weighted residual factors for significantly intense reflections	0.2103
Weighted residual factors for all reflections included in the refinement	0.2104
Goodness-of-fit parameter for all reflections included in the refinement	1.33
Diffraction radiation wavelength	0.71246 Å
Diffraction radiation type	synchrotron
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179874 (current)	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/70.	7017078.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7017078.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7017078.cif
30044	2011-11-09	../uploads/cif-deposit/cod/cif Adding structures of 7017077, 7017078, 7017079 via cif-deposit CGI script.	7017078.cif