Crystallography Open Database

Information card for entry 4030570

Preview

Coordinates	4030570.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C94.5 H102.25 N Si3
Calculated formula	C94.5 H102.25 N Si3
Title of publication	Synthesis and properties of arylvinylidene-bridged triphenylamines.
Authors of publication	Hammer, Natalie; Shubina, Tatyana E.; Gisselbrecht, Jean-Paul; Hampel, Frank; Kivala, Milan
Journal of publication	The Journal of organic chemistry
Year of publication	2015
Journal volume	80
Journal issue	4
Pages of publication	2418 - 2424
a	20.0898 ± 0.0004 Å
b	29.1629 ± 0.0005 Å
c	30.126 ± 0.0006 Å
α	93.1848 ± 0.0015°
β	103.524 ± 0.0016°
γ	107.635 ± 0.0017°
Cell volume	16201.4 ± 0.6 Å³
Cell temperature	173 ± 0.1 K
Ambient diffraction temperature	173 ± 0.1 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0935
Residual factor for significantly intense reflections	0.071
Weighted residual factors for significantly intense reflections	0.192
Weighted residual factors for all reflections included in the refinement	0.2083
Goodness-of-fit parameter for all reflections included in the refinement	1.035
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4030570.html