Crystallography Open Database

Information card for entry 7241798

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Coordinates	7241798.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H70 N3 O17.5
Calculated formula	C49 H63 N3 O17.5
Title of publication	Crystal engineering of coordination polymers using flexible tetracarboxylate linkers with embedded cyclohexyldiamine cores
Authors of publication	Chahine, Ali Y.; Turner, David R.; Batten, Stuart R.
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	3
Pages of publication	569 - 590
a	8.2759 ± 0.0002 Å
b	11.7985 ± 0.0002 Å
c	13.6442 ± 0.0003 Å
α	85.64 ± 0.002°
β	75.452 ± 0.002°
γ	86.886 ± 0.002°
Cell volume	1284.96 ± 0.05 Å³
Cell temperature	122.99 ± 0.1 K
Ambient diffraction temperature	122.99 ± 0.1 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0871
Residual factor for significantly intense reflections	0.078
Weighted residual factors for significantly intense reflections	0.2317
Weighted residual factors for all reflections included in the refinement	0.2445
Goodness-of-fit parameter for all reflections included in the refinement	1.075
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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