Crystallography Open Database

Information card for entry 7242056

7242055 << 7242056 >> 7242057

Preview

Coordinates	7242056.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C69.38 H22.4 Cl3 Co F20 N12 O3.38
Calculated formula	C69.37 H22.5 Cl3 Co F20 N12 O3.38
Title of publication	The synthesis and characterization of the octahedral CoIII complex of a pyrrolopyrrolizine derivative formed with dicyanovinylene-bis-(meso-aryl)dipyrrin
Authors of publication	Shin, Ji-Young
Journal of publication	RSC Advances
Year of publication	2021
Journal volume	11
Journal issue	4
Pages of publication	2315 - 2319
a	11.204 ± 0.005 Å
b	16.844 ± 0.005 Å
c	18.858 ± 0.005 Å
α	63.767 ± 0.005°
β	83.998 ± 0.005°
γ	77.38 ± 0.005°
Cell volume	3115.1 ± 1.9 Å³
Cell temperature	93 ± 2 K
Ambient diffraction temperature	93 ± 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	0.1385
Residual factor for significantly intense reflections	0.0972
Weighted residual factors for significantly intense reflections	0.2688
Weighted residual factors for all reflections included in the refinement	0.2944
Goodness-of-fit parameter for all reflections included in the refinement	1.072
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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