Crystallography Open Database

Information card for entry 7209919

7209918 << 7209919 >> 7209920

Preview

Coordinates	7209919.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H36 Co4 N4 O14
Calculated formula	C54 H34 Co4 N4 O14
Title of publication	Unprecedented 1D alternate Co5 chain and discrete Co3 unit embedded in a 3D framework exhibiting slow magnetic relaxation behaviour
Authors of publication	Liu, Bo; Liu, Bin; Pang, Lingyan; Yang, Guoping; Cui, Lin; Wang, Yao-Yu; Shi, Qizhen
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	26
Pages of publication	5205
a	8.1571 ± 0.001 Å
b	14.7919 ± 0.0018 Å
c	20.877 ± 0.003 Å
α	108.625 ± 0.002°
β	95.964 ± 0.002°
γ	98.671 ± 0.002°
Cell volume	2328.5 ± 0.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0902
Residual factor for significantly intense reflections	0.0537
Weighted residual factors for significantly intense reflections	0.1325
Weighted residual factors for all reflections included in the refinement	0.1612
Goodness-of-fit parameter for all reflections included in the refinement	0.99
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
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.	7209919.cif
86877	2013-07-12	cif/ Adding structures of 7209919 via cif-deposit CGI script.	7209919.cif