Crystallography Open Database

Information card for entry 7048008

Preview

Coordinates	7048008.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H40 Br F6 Ni O P2 Sb
Calculated formula	C28 H40 Br F6 Ni O P2 Sb
Title of publication	Redox-state dependent activation of silanes and ammonia with reverse polarity (PC<sub>carbene</sub>P)Ni complexes: electrophilic vs. nucleophilic carbenes.
Authors of publication	LaPierre, Etienne A.; Piers, Warren E.; Gendy, Chris
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	46
Pages of publication	16789 - 16797
a	16.4321 ± 0.0004 Å
b	14.2612 ± 0.0005 Å
c	16.6228 ± 0.0005 Å
α	90°
β	110.71 ± 0.002°
γ	90°
Cell volume	3643.7 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	8
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	0.0912
Residual factor for significantly intense reflections	0.045
Weighted residual factors for significantly intense reflections	0.0976
Weighted residual factors for all reflections included in the refinement	0.1125
Goodness-of-fit parameter for all reflections included in the refinement	0.998
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
229647 (current)	2019-11-17	cif/ Updating files of 7048006, 7048007, 7048008, 7048009, 7048010, 7048011, 7048012 Original log message: Adding full bibliography for 7048006--7048012.cif.	7048008.cif
211865	2018-11-09	cif/ Adding structures of 7048006, 7048007, 7048008, 7048009, 7048010, 7048011, 7048012 via cif-deposit CGI script.	7048008.cif