Crystallography Open Database

Information card for entry 7715954

Preview

Coordinates	7715954.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H16 B4 F8 N6 O2
Calculated formula	C24 H16 B4 F8 N6 O2
Title of publication	Simultaneous discovery of chiral and achiral dyes: elucidating the optical functions of helical and flag-hinged boron tetradentate complexes.
Authors of publication	Cui, Luxia; Furuta, Ryoji; Harada, Takunori; Konta, Takeru; Hoshino, Yu; Ono, Toshikazu
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	21
Pages of publication	9183 - 9191
a	18.914 ± 0.0002 Å
b	18.914 ± 0.0002 Å
c	27.7587 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	9930.4 ± 0.2 Å³
Cell temperature	100.02 ± 0.1 K
Ambient diffraction temperature	100.02 ± 0.1 K
Number of distinct elements	6
Space group number	142
Hermann-Mauguin space group symbol	I 41/a c d :2
Hall space group symbol	-I 4bd 2c
Residual factor for all reflections	0.0443
Residual factor for significantly intense reflections	0.0418
Weighted residual factors for significantly intense reflections	0.1248
Weighted residual factors for all reflections included in the refinement	0.127
Goodness-of-fit parameter for all reflections included in the refinement	1.081
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
293157 (current)	2024-07-05	cif/ Updating files of 7715954, 7715955, 7715956, 7715957, 7715958 Original log message: Adding full bibliography for 7715954--7715958.cif.	7715954.cif
291760	2024-05-08	cif/ Adding structures of 7715954, 7715955, 7715956, 7715957, 7715958 via cif-deposit CGI script.	7715954.cif