Crystallography Open Database

Information card for entry 3000149

Preview

No preview available: structure is on hold until 2018-03-30

Coordinates	Coordinates are not available: structure is on hold until 2018-03-30

Structure parameters

Common name	1,1'-binaphthyl
Chemical name	1,1'-binaphthyl
Formula	C20 H14
Title of publication	?
Authors of publication	Roszak Kinga; Katrusiak, Andrzej
Journal of publication	To be published in PCCP
a	6.8496 ± 0.0004 Å
b	6.8496 ± 0.0004 Å
c	26.691 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	1252.26 ± 0.17 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Cell measurement pressure	1530000 kPa
Number of distinct elements	2
Hermann-Mauguin space group symbol	P 41 21 2
Hall space group symbol	P 4abw 2nw
Residual factor for all reflections	0.12
Residual factor for significantly intense reflections	0.1095
Weighted residual factors for significantly intense reflections	0.1673
Weighted residual factors for all reflections included in the refinement	0.1692
Goodness-of-fit parameter for all reflections included in the refinement	1.053
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	No
Has disorder	No
Has F_obs	No

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