Crystallography Open Database

Information card for entry 4067155

Preview

Coordinates	4067155.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H40 N4 Zn2
Calculated formula	C18 H40 N4 Zn2
SMILES	C(C)(C)[N]1[Zn]2(C)[N](C=1C)(C(C)C)[Zn]1(C)[N](=C(C)[N]21C(C)C)C(C)C
Title of publication	Synthesis and Structural Characterization of New Zinc Amidinate Complexes
Authors of publication	Schmidt, Sarah; Schulz, Stephan; Bläser, Dieter; Boese, Roland; Bolte, Michael
Journal of publication	Organometallics
Year of publication	2010
Journal volume	29
Journal issue	22
Pages of publication	6097
a	11.3479 ± 0.0017 Å
b	11.3479 ± 0.0017 Å
c	17.819 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	2294.6 ± 0.6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	4
Space group number	96
Hermann-Mauguin space group symbol	P 43 21 2
Hall space group symbol	P 4nw 2abw
Residual factor for all reflections	0.0279
Residual factor for significantly intense reflections	0.0229
Weighted residual factors for significantly intense reflections	0.053
Weighted residual factors for all reflections included in the refinement	0.0548
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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