Crystallography Open Database

Information card for entry 7061160

Preview

Coordinates	7061160.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H56 Er N3 Si2
Calculated formula	C39 H56 Er N3 Si2
Title of publication	Synthesis, structure, and coordination chemistry of a neutral pyrrolyl-functionalized amidinate ligand
Authors of publication	Guo, Liping; Guo, Changjia; Peng, Shuqi; Song, Renyuan
Journal of publication	New Journal of Chemistry
Year of publication	2022
Journal volume	46
Journal issue	5
Pages of publication	2465 - 2471
a	11.4267 ± 0.0008 Å
b	18.5276 ± 0.0013 Å
c	20.0773 ± 0.0014 Å
α	93.515 ± 0.001°
β	98.153 ± 0.001°
γ	98.18 ± 0.001°
Cell volume	4150.4 ± 0.5 Å³
Cell temperature	298.15 K
Ambient diffraction temperature	298.15 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	0.0366
Residual factor for significantly intense reflections	0.025
Weighted residual factors for significantly intense reflections	0.0551
Weighted residual factors for all reflections included in the refinement	0.0603
Goodness-of-fit parameter for all reflections included in the refinement	1.01
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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