Crystallography Open Database

Information card for entry 7048371

Preview

Coordinates	7048371.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H33 Cl N P Ti
Calculated formula	C30 H33 Cl N P Ti
Title of publication	Teaching c-phosphanylimines the titanaaziridine coordination mode.
Authors of publication	Fischer, Malte; Steinert, Henning; Schmidtmann, Marc; Beckhaus, Ruediger
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	6
Pages of publication	1936 - 1940
a	10.7515 ± 0.0004 Å
b	16.5847 ± 0.0006 Å
c	16.1243 ± 0.0006 Å
α	90°
β	108.888 ± 0.001°
γ	90°
Cell volume	2720.31 ± 0.17 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 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	0.0501
Residual factor for significantly intense reflections	0.036
Weighted residual factors for significantly intense reflections	0.0921
Weighted residual factors for all reflections included in the refinement	0.101
Goodness-of-fit parameter for all reflections included in the refinement	1.044
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
224147 (current)	2019-11-07	cif/ Updating files of 7048370, 7048371 Original log message: Adding full bibliography for 7048370--7048371.cif.	7048371.cif
212630	2018-12-18	cif/ Adding structures of 7048370, 7048371 via cif-deposit CGI script.	7048371.cif