Crystallography Open Database

Information card for entry 7159695

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Coordinates	7159695.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H15 F6 N5 S
Calculated formula	C23 H15 F6 N5 S
Title of publication	A chloride-responsive molecular switch: driving ion transport and empowering antibacterial properties.
Authors of publication	Das, Sribash; Karn, Rama; Kumar, Mohit; Srimayee, Soumya; Manna, Debasis
Journal of publication	Organic & biomolecular chemistry
Year of publication	2023
Journal volume	22
Journal issue	1
Pages of publication	114 - 119
a	26.509 ± 0.006 Å
b	8.6693 ± 0.0018 Å
c	19.55 ± 0.004 Å
α	90°
β	102.969 ± 0.005°
γ	90°
Cell volume	4378.3 ± 1.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1474
Residual factor for significantly intense reflections	0.1085
Weighted residual factors for significantly intense reflections	0.1654
Weighted residual factors for all reflections included in the refinement	0.1844
Goodness-of-fit parameter for all reflections included in the refinement	1.201
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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