Crystallography Open Database

Information card for entry 7048531

Preview

Coordinates	7048531.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	HC(tBupz)2SiMe2N(H)Ph
Chemical name	(tBupz)2CHSiMe2NHPh
Formula	C31 H51 N5 Si
Calculated formula	C31 H51 N5 Si
Title of publication	Magnesium, calcium and zinc [N<sub>2</sub>N'] heteroscorpionate complexes.
Authors of publication	Luna Barros, Mariana; Cushion, Michael G.; Schwarz, Andrew D.; Turner, Zoë R; Mountford, Philip
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	13
Pages of publication	4124 - 4138
a	8.8605 ± 0.0001 Å
b	19.3115 ± 0.0002 Å
c	19.2772 ± 0.0002 Å
α	90°
β	97.144 ± 0.001°
γ	90°
Cell volume	3272.91 ± 0.06 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0565
Residual factor for significantly intense reflections	0.0464
Weighted residual factors for significantly intense reflections	0.1183
Weighted residual factors for all reflections included in the refinement	0.1266
Goodness-of-fit parameter for all reflections included in the refinement	1.023
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
224283 (current)	2019-11-08	cif/ Updating files of 7048527, 7048528, 7048529, 7048530, 7048531, 7048532, 7048533, 7048534, 7048535, 7048536, 7048537, 7048538 Original log message: Adding full bibliography for 7048527--7048538.cif.	7048531.cif
212959	2019-01-11	cif/ Adding structures of 7048527, 7048528, 7048529, 7048530, 7048531, 7048532, 7048533, 7048534, 7048535, 7048536, 7048537, 7048538 via cif-deposit CGI script.	7048531.cif