Crystallography Open Database

Information card for entry 7700521

Preview

Coordinates	7700521.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C53 H72 B N5 O2 Si
Calculated formula	C53 H72 B N5 O2 Si
Title of publication	Synthesis and reactivity of boryl substituted silaimines.
Authors of publication	Yuvaraj, K.; Jones, Cameron
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	31
Pages of publication	11961 - 11965
a	9.9426 ± 0.0001 Å
b	20.1639 ± 0.0003 Å
c	24.4987 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	4911.54 ± 0.11 Å³
Cell temperature	123 ± 2 K
Ambient diffraction temperature	123 ± 2 K
Number of distinct elements	6
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0506
Residual factor for significantly intense reflections	0.0485
Weighted residual factors for significantly intense reflections	0.1254
Weighted residual factors for all reflections included in the refinement	0.1269
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
224362 (current)	2019-11-08	cif/ Updating files of 7700519, 7700520, 7700521, 7700522, 7700523, 7700524, 7700525, 7700526 Original log message: Adding full bibliography for 7700519--7700526.cif.	7700521.cif
216991	2019-07-13	cif/ Adding structures of 7700519, 7700520, 7700521, 7700522, 7700523, 7700524, 7700525, 7700526 via cif-deposit CGI script.	7700521.cif