Crystallography Open Database

Information card for entry 7204089

7204088 << 7204089 >> 7204090

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Coordinates	7204089.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C90 H80 Cl4 Mn N8
Calculated formula	C90 H78 Cl4 Mn N8
Title of publication	Ferrimagnetic ordering of one-dimensional N,N'-dicyanoquinone diimine (DCNQI) electron transfer salts with porphyrinatomanganese(II)
Authors of publication	Sugiura, Ken-ichi; Mikami, Shinji; Johnson, Mitchell T.; Raebiger, James W.; Miller, Joel S.; Iwasaki, Kentaro; Okada, Yuko; Hino, Shojun; Sakata, Yoshiteru
Journal of publication	Journal of Materials Chemistry
Year of publication	2001
Journal volume	11
Journal issue	9
Pages of publication	2152
a	12.988 ± 0.005 Å
b	20.02 ± 0.006 Å
c	15.548 ± 0.005 Å
α	90°
β	104.6 ± 0.03°
γ	90°
Cell volume	3912 ± 2 Å³
Cell temperature	198.2 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 significantly intense reflections	0.1095
Weighted residual factors for all reflections included in the refinement	0.1653
Goodness-of-fit parameter for all reflections included in the refinement	1.942
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7204089.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7204089.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7204089.cif
3890	2010-12-07	cif/7/ Adding CIFs with data extracted from New-J-Chem-2004-2000/, Org-Biomol-Chem-2004-2000/ and RSC-2004-2000/.	7204089.cif