Crystallography Open Database

Information card for entry 7041169

Preview

Coordinates	7041169.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H21 Br3 Fe Mn N8 O3
Calculated formula	C34 H21 Br3 Fe Mn N8 O3
Title of publication	Tuning of chain chirality by interchain stacking forces and the structure-property relationship in coordination systems constructed by meridional Fe(III) cyanide and Mn(III) Schiff bases.
Authors of publication	Sohn, Ah Ram; Lim, Kwang Soo; Kang, Dong Won; Song, Jeong Hwa; Koh, Eui Kwan; Moon, Dohyun; Hong, Chang Seop
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	48
Pages of publication	19416 - 19427
a	10.4788 ± 0.0004 Å
b	12.8922 ± 0.0004 Å
c	26.6392 ± 0.0009 Å
α	90°
β	96.718 ± 0.002°
γ	90°
Cell volume	3574.1 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0773
Residual factor for significantly intense reflections	0.0535
Weighted residual factors for significantly intense reflections	0.1219
Weighted residual factors for all reflections included in the refinement	0.1324
Goodness-of-fit parameter for all reflections included in the refinement	1.053
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
190123 (current)	2017-01-09	cif/ Updating files of 7041162, 7041163, 7041164, 7041165, 7041166, 7041167, 7041168, 7041169 Original log message: Adding full bibliography for 7041162--7041169.cif.	7041169.cif
188399	2016-11-12	cif/ Adding structures of 7041162, 7041163, 7041164, 7041165, 7041166, 7041167, 7041168, 7041169 via cif-deposit CGI script.	7041169.cif