Crystallography Open Database

Information card for entry 4319686

4319685 << 4319686 >> 4319687

Preview

Coordinates	4319686.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H20 Mn N9 P
Calculated formula	C30 H20 Mn N9 P
Title of publication	1-D and 2-D Homoleptic Dicyanamide Structures, [Ph4P]2{CoII[N(CN)2]4} and [Ph4P]{M[N(CN)2]3} (M = Mn, Co)
Authors of publication	James W. Raebiger; Jamie L. Manson; Roger D. Sommer; Urs Geiser; Arnold L. Rheingold; Joel S. Miller
Journal of publication	Inorganic Chemistry
Year of publication	2001
Journal volume	40
Pages of publication	2578 - 2581
a	13.3903 ± 0.0006 Å
b	7.5745 ± 0.0003 Å
c	14.3935 ± 0.0006 Å
α	90°
β	99.663 ± 0.002°
γ	90°
Cell volume	1439.15 ± 0.11 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	5
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.0506
Residual factor for significantly intense reflections	0.0344
Weighted residual factors for significantly intense reflections	0.0894
Weighted residual factors for all reflections included in the refinement	0.0949
Goodness-of-fit parameter for all reflections included in the refinement	1.064
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
179276 (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 4/31/96.	4319686.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4319686.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4319686.cif
16487	2011-03-24	../uploads/cif-deposit/cod/cif Adding structures of 4319686 via cif-deposit CGI script.	4319686.cif