Crystallography Open Database

Information card for entry 7046844

Preview

Coordinates	7046844.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H30 B F10 N Si
Calculated formula	C28 H30 B F10 N Si
Title of publication	Formation of borata-alkene/iminium zwitterions by ynamine hydroboration.
Authors of publication	Wang, Long; Jian, Zhongbao; Daniliuc, Constantin G.; Kehr, Gerald; Erker, Gerhard
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	32
Pages of publication	10853 - 10856
a	10.019 ± 0.0002 Å
b	19.0596 ± 0.0003 Å
c	15.5129 ± 0.0003 Å
α	90°
β	94.422 ± 0.001°
γ	90°
Cell volume	2953.5 ± 0.09 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0703
Residual factor for significantly intense reflections	0.0542
Weighted residual factors for significantly intense reflections	0.1216
Weighted residual factors for all reflections included in the refinement	0.1326
Goodness-of-fit parameter for all reflections included in the refinement	1.071
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
229369 (current)	2019-11-17	cif/ Updating files of 7046836, 7046837, 7046838, 7046839, 7046840, 7046841, 7046842, 7046843, 7046844, 7046845 Original log message: Adding full bibliography for 7046836--7046845.cif.	7046844.cif
208612	2018-06-23	cif/ Adding structures of 7046836, 7046837, 7046838, 7046839, 7046840, 7046841, 7046842, 7046843, 7046844, 7046845 via cif-deposit CGI script.	7046844.cif