Crystallography Open Database

Information card for entry 7124378

Preview

Coordinates	7124378.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H72 N2 O3 Si6
Calculated formula	C60 H72 N2 O3 Si6
Title of publication	Synthesis of Structured Polysiloxazanes via Piers‒Rubinsztajn Reaction
Authors of publication	Ai, Liqing; Chen, Yi; He, Lijuan; Luo, Yongming; Li, Shuhong; Xu, Caihong
Journal of publication	Chemical Communications
Year of publication	2019
a	9.7614 ± 0.0001 Å
b	13.3279 ± 0.0002 Å
c	22.9045 ± 0.0003 Å
α	97.113 ± 0.001°
β	100.509 ± 0.001°
γ	97.927 ± 0.001°
Cell volume	2867.71 ± 0.07 Å³
Cell temperature	169.99 ± 0.1 K
Ambient diffraction temperature	169.99 ± 0.1 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0409
Residual factor for significantly intense reflections	0.0384
Weighted residual factors for significantly intense reflections	0.1015
Weighted residual factors for all reflections included in the refinement	0.1031
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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