Crystallography Open Database

Information card for entry 4071933

4071932 << 4071933 >> 4071934

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Coordinates	4071933.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H50 N4 O3 Sn2
Calculated formula	C36 H50 N4 O3 Sn2
SMILES	C(N(C)C)c1c([Sn](O[Sn](c2c(cccc2)CN(C)C)(O)c2c(cccc2)CN(C)C)(c2c(cccc2)CN(C)C)O)cccc1
Title of publication	Solvent-Controlled Ring Size in Double C,N-Chelated Stannoxanes⊥
Authors of publication	Padělková, Zdeňka; Nechaev, Mikhail S.; Černošek, Zdeněk; Brus, Jiří; Růžička, Aleš
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	20
Pages of publication	5303
a	25.3256 ± 0.0009 Å
b	9.5907 ± 0.0008 Å
c	16.5939 ± 0.0008 Å
α	90°
β	120.24 ± 0.04°
γ	90°
Cell volume	3482 ± 1.5 Å³
Cell temperature	150 ± 1 K
Ambient diffraction temperature	150 ± 1 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.076
Residual factor for significantly intense reflections	0.0432
Weighted residual factors for significantly intense reflections	0.0716
Weighted residual factors for all reflections included in the refinement	0.0853
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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