Crystallography Open Database

Information card for entry 4127250

Preview

Coordinates	4127250.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40.67 H22.33 B12 F20 N4
Calculated formula	C40.675 H22.325 B12 F20 N4
Title of publication	Structural Characterization of a Boron(III) η<sup>2</sup>-σ-Silane-Complex.
Authors of publication	Liu, Yizhen; Su, Bo; Dong, Weishi; Li, Zhen Hua; Wang, Huadong
Journal of publication	Journal of the American Chemical Society
Year of publication	2019
Journal volume	141
Journal issue	20
Pages of publication	8358 - 8363
a	19.568 ± 0.003 Å
b	13.466 ± 0.0019 Å
c	36.178 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	9533 ± 2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for all reflections	0.1082
Residual factor for significantly intense reflections	0.0623
Weighted residual factors for significantly intense reflections	0.1549
Weighted residual factors for all reflections included in the refinement	0.184
Goodness-of-fit parameter for all reflections included in the refinement	0.932
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
223195 (current)	2019-11-04	cif/ Updating files of 4127250, 4127251, 4127252 Original log message: Adding full bibliography for 4127250--4127252.cif.	4127250.cif
215097	2019-05-13	cif/ Adding structures of 4127250 via cif-deposit CGI script.	4127250.cif