Crystallography Open Database

Information card for entry 7247143

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Coordinates	7247143.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H14 B N3 O3
Calculated formula	C20 H17 B N3 O3
Title of publication	Supramolecular assemblies in the molecular complexes of 4-cyanophenylboronic acid with different N-donor ligands
Authors of publication	Easmin, Samina; Pedireddi, Venkateswara Rao
Journal of publication	RSC Advances
Year of publication	2023
Journal volume	13
Journal issue	33
Pages of publication	23267 - 23284
a	3.8278 ± 0.0003 Å
b	17.1899 ± 0.0006 Å
c	26.2562 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	1727.64 ± 0.16 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0923
Residual factor for significantly intense reflections	0.0539
Weighted residual factors for significantly intense reflections	0.125
Weighted residual factors for all reflections included in the refinement	0.1457
Goodness-of-fit parameter for all reflections included in the refinement	1.009
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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