Crystallography Open Database

Information card for entry 4316870

Preview

Coordinates	4316870.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H22 Cl5 N4 O8 Pt Ru2 S4
Calculated formula	C22 H20 Cl5 N4 O8 Pt Ru2 S4
Title of publication	Magnetic/Conducting Bifunctionality due to π/σ-Conjugated Functional Moieties in a Stacked Ferrimagnetic Chain
Authors of publication	Hitoshi Miyasaka; Yuichiro Asai; Natsuko Motokawa; Kazuya Kubo; Masahiro Yamashita
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	9116 - 9118
a	25.336 ± 0.005 Å
b	16.26 ± 0.003 Å
c	9.0323 ± 0.0017 Å
α	90°
β	94.076 ± 0.003°
γ	90°
Cell volume	3711.6 ± 1.2 Å³
Cell temperature	93.1 K
Ambient diffraction temperature	93.1 K
Number of distinct elements	8
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for significantly intense reflections	0.0472
Weighted residual factors for all reflections included in the refinement	0.1187
Goodness-of-fit parameter for all reflections included in the refinement	1.139
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4316870.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4316870.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4316870.cif
10379	2011-02-11	../uploads/cif-deposit/cod/cif Adding structures of 4316870 via cif-deposit CGI script.	4316870.cif