Crystallography Open Database

Information card for entry 4316551

Preview

Coordinates	4316551.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C5 H5 Mn N9 O
Calculated formula	C5 H5 Mn N9 O
Title of publication	Mixed Azide and 5-(Pyrimidyl)tetrazole Bridged Co(II)/Mn(II) Polymers: Synthesis, Crystal Structures, Ferroelectric and Magnetic Behavior
Authors of publication	Oindrila Sengupta; Partha Sarathi Mukherjee
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	8583 - 8590
a	8.78 ± 0.005 Å
b	6.423 ± 0.005 Å
c	16.159 ± 0.005 Å
α	90°
β	90.036 ± 0.005°
γ	90°
Cell volume	911.3 ± 0.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0507
Residual factor for significantly intense reflections	0.0433
Weighted residual factors for significantly intense reflections	0.101
Weighted residual factors for all reflections included in the refinement	0.105
Goodness-of-fit parameter for all reflections included in the refinement	1.139
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179245 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/65.	4316551.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4316551.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4316551.cif
9755	2011-02-10	../uploads/cif-deposit/cod/cif Adding structures of 4316551 via cif-deposit CGI script.	4316551.cif