Crystallography Open Database

Information card for entry 7714771

Preview

Coordinates	7714771.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H20 As B S2
Calculated formula	C23 H20 As B S2
Title of publication	Synthesis, structures, and photophysical properties of π-extended arsaborins.
Authors of publication	Sumida, Akifumi; Onishi, Tomoharu; Imoto, Hiroaki; Naka, Kensuke
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2024
Journal volume	53
Journal issue	4
Pages of publication	1706 - 1713
a	10.0361 ± 0.0006 Å
b	12.8683 ± 0.0008 Å
c	17.6889 ± 0.0011 Å
α	108.955 ± 0.006°
β	91.163 ± 0.005°
γ	104.195 ± 0.005°
Cell volume	2082.1 ± 0.2 Å³
Cell temperature	173.15 K
Ambient diffraction temperature	173.15 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	0.0639
Residual factor for significantly intense reflections	0.0459
Weighted residual factors for significantly intense reflections	0.1102
Weighted residual factors for all reflections included in the refinement	0.1244
Goodness-of-fit parameter for all reflections included in the refinement	1.031
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
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/7714771.html