Crystallography Open Database

Information card for entry 7026538

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Coordinates	7026538.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H53 Cl5 N4
Calculated formula	C39 H53 Cl5 N4
Title of publication	Coordination study of a new class of imine imidazol-2-imine ligands to titanium(IV) and palladium(II).
Authors of publication	Dastgir, Sarim; Lavoie, Gino G.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	30
Pages of publication	6943 - 6946
a	10.9207 ± 0.0003 Å
b	23.5718 ± 0.0006 Å
c	16.7583 ± 0.0004 Å
α	90°
β	108.072 ± 0.0012°
γ	90°
Cell volume	4101.11 ± 0.18 Å³
Cell temperature	150 ± 1 K
Ambient diffraction temperature	150 ± 1 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	0.101
Residual factor for significantly intense reflections	0.072
Weighted residual factors for significantly intense reflections	0.185
Weighted residual factors for all reflections included in the refinement	0.2027
Goodness-of-fit parameter for all reflections included in the refinement	1.094
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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