Crystallography Open Database

Information card for entry 7717166

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Coordinates	7717166.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H28 Co1.5 N6 O4
Calculated formula	C44 H28 Co1.5 N6 O4
Title of publication	Design and synthesis of pillared metal-organic frameworks featuring olefinic fragments.
Authors of publication	Mander, Rachel Leigh; Schmidt, Ashley; Ruf, Michael; Korzyński, Maciej Damian
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	47
Pages of publication	18873 - 18879
a	45.43 ± 0.002 Å
b	16.6225 ± 0.0004 Å
c	16.6156 ± 0.0004 Å
α	90°
β	111.481 ± 0.002°
γ	90°
Cell volume	11675.9 ± 0.7 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	5
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.1869
Residual factor for significantly intense reflections	0.129
Weighted residual factors for significantly intense reflections	0.2908
Weighted residual factors for all reflections included in the refinement	0.3217
Goodness-of-fit parameter for all reflections included in the refinement	1.325
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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