Crystallography Open Database

Information card for entry 3000600

Preview

No preview available: structure is on hold until 2025-11-19

Coordinates	Coordinates are not available: structure is on hold until 2025-11-19

Structure parameters

Formula	C18 H17 B F2 O4
Authors of publication	Fuyuki Ito
Journal of publication	To be published in Chemical Communication
a	8.9188 ± 0.0004 Å
b	10.5744 ± 0.0006 Å
c	17.1101 ± 0.0009 Å
α	95.606 ± 0.004°
β	90.859 ± 0.004°
γ	92.126 ± 0.004°
Cell volume	1604.57 ± 0.14 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0826
Residual factor for significantly intense reflections	0.0694
Weighted residual factors for significantly intense reflections	0.1956
Weighted residual factors for all reflections included in the refinement	0.212
Goodness-of-fit parameter for all reflections included in the refinement	0.95
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.812 Å
Diffraction radiation type	synchrotron
Has coordinates	No
Has disorder	No
Has F_obs	No

Version history

Not available for prepublication material.