Crystallography Open Database

Information card for entry 2021789

2021788 << 2021789 >> 2021790

Preview

Coordinates	2021789.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	<i>catena</i>-Poly[[[<i>N</i>,<i>N</i>'-(1,2-phenylene)bis(pyridine-2-carboxamidato)-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''']iron(III)]-μ-cyanido-κ^2^<i>C</i>:<i>N</i>-[bis(4,4'-bipyridine-κ<i>N</i>)bis(methanol-κ<i>O</i>)manganese(II)]-μ-cyanido-κ^2^<i>N</i>:<i>C</i>]
Formula	C42 H36 Cl Fe Mn N10 O8
Calculated formula	C42 H36 Cl Fe Mn N10 O8
Title of publication	A cyanide-bridged Fe^III^‒Mn^II^ heterobimetallic one-dimensional coordination polymer: synthesis, crystal structure, experimental and theoretical magnetism investigation
Authors of publication	Lan, Wenlong; Zhou, Zhen; Li, Jie; Dou, Yong; Hao, Xiaoyun; Yang, Lu; Liu, Hui; Li, Dacheng; Liu, Qingyun; Zhang, Daopeng
Journal of publication	Acta Crystallographica Section C
Year of publication	2019
Journal volume	75
Journal issue	11
a	10.404 ± 0.003 Å
b	13.969 ± 0.004 Å
c	16.226 ± 0.004 Å
α	113.317 ± 0.004°
β	104.231 ± 0.004°
γ	90.973 ± 0.004°
Cell volume	2081.8 ± 1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1293
Residual factor for significantly intense reflections	0.0594
Weighted residual factors for significantly intense reflections	0.1462
Weighted residual factors for all reflections included in the refinement	0.1768
Goodness-of-fit parameter for all reflections included in the refinement	0.984
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
219112 (current)	2019-10-05	cif/ Adding structures of 2021789 via cif-deposit CGI script.	2021789.cif