Crystallography Open Database

Information card for entry 4314925

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Coordinates	4314925.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H30 N3 Ti
Calculated formula	C19 H30 N3 Ti
Title of publication	A Family of Heteroleptic Titanium Guanidinates: Synthesis, Thermolysis, and Surface Reactivity
Authors of publication	Yamile A. Wasslen; Eva Tois; Suvi Haukka; Kevin A. Kreisel; Glenn P. A. Yap; Mathew D. Halls; Seán T. Barry
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	1976 - 1982
a	8.1809 ± 0.0006 Å
b	8.1809 ± 0.0006 Å
c	28.121 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	1882.1 ± 0.3 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	4
Space group number	138
Hermann-Mauguin space group symbol	P 42/n c m :2
Hall space group symbol	-P 4ac 2ac
Residual factor for all reflections	0.0792
Residual factor for significantly intense reflections	0.0578
Weighted residual factors for significantly intense reflections	0.1901
Weighted residual factors for all reflections included in the refinement	0.2128
Goodness-of-fit parameter for all reflections included in the refinement	1.055
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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