Crystallography Open Database

Information card for entry 4132001

4132000 << 4132001 >> 4132002

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Coordinates	4132001.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	N-triphenylsilylimidobis(N-2,6-diisopropylphenylbenzamido)pyridine titanium(IV)
Formula	C244 H256 N16 O8 Si4 Ti4
Calculated formula	C244 H256 N16 O8 Si4 Ti4
Title of publication	Regio- and Stereoselective Hydroamination of Alkynes Using an Ammonia Surrogate: Synthesis of N-Silylenamines as Reactive Synthons.
Authors of publication	Lui, Erica K. J.; Brandt, Jason W.; Schafer, Laurel L.
Journal of publication	Journal of the American Chemical Society
Year of publication	2018
Journal volume	140
Journal issue	15
Pages of publication	4973 - 4976
a	12.843 Å
b	20.558 Å
c	23.39 Å
α	72.79°
β	77.72°
γ	72.76°
Cell volume	5580.91 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0556
Residual factor for significantly intense reflections	0.0396
Weighted residual factors for significantly intense reflections	0.0965
Weighted residual factors for all reflections included in the refinement	0.1046
Goodness-of-fit parameter for all reflections included in the refinement	1.028
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
242044 (current)	2019-11-25	cif/ Adding structures of 4132001 via cif-deposit CGI script.	4132001.cif