Crystallography Open Database

Information card for entry 7048570

Preview

Coordinates	7048570.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H16 B Cl3 N O3
Calculated formula	C22 H15 B Cl3 N O3
Title of publication	Investigation of the Lewis acidic behaviour of an oxygen-bridged planarized triphenylborane toward amines and the properties of their Lewis acid-base adducts.
Authors of publication	Kitamoto, Yuichi; Kobayashi, Fumiaki; Suzuki, Takatsugu; Miyata, Yasuo; Kita, Hiroshi; Funaki, Kenji; Oi, Shuichi
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	6
Pages of publication	2118 - 2127
a	23.783 ± 0.003 Å
b	9.9498 ± 0.001 Å
c	18.2611 ± 0.0019 Å
α	90°
β	113.215 ± 0.001°
γ	90°
Cell volume	3971.4 ± 0.8 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
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	0.0474
Residual factor for significantly intense reflections	0.0444
Weighted residual factors for significantly intense reflections	0.1192
Weighted residual factors for all reflections included in the refinement	0.1218
Goodness-of-fit parameter for all reflections included in the refinement	1.042
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
224145 (current)	2019-11-07	cif/ Updating files of 7048570, 7048571, 7048572 Original log message: Adding full bibliography for 7048570--7048572.cif.	7048570.cif
212969	2019-01-11	cif/ Adding structures of 7048570, 7048571, 7048572 via cif-deposit CGI script.	7048570.cif