Crystallography Open Database

Information card for entry 7048572

Preview

Coordinates	7048572.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H46 B N O3
Calculated formula	C37 H22 B 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	17.996 ± 0.003 Å
b	8.254 ± 0.0016 Å
c	10.502 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	1560 ± 0.6 Å³
Cell temperature	223 ± 3 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	5
Space group number	31
Hermann-Mauguin space group symbol	P m n 21
Hall space group symbol	P 2ac -2
Residual factor for all reflections	0.0962
Residual factor for significantly intense reflections	0.0802
Weighted residual factors for significantly intense reflections	0.2337
Weighted residual factors for all reflections included in the refinement	0.2548
Goodness-of-fit parameter for all reflections included in the refinement	1.019
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
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.	7048572.cif
212969	2019-01-11	cif/ Adding structures of 7048570, 7048571, 7048572 via cif-deposit CGI script.	7048572.cif