Crystallography Open Database

Information card for entry 7059682

Preview

Coordinates	7059682.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H21 B10 N3
Calculated formula	C10 H21 B10 N3
Title of publication	Synthesis and structure of 3-arylazo derivatives of ortho-carborane
Authors of publication	Shmalko, Akim V.; Anufriev, Sergei A.; Stogniy, Marina Yu.; Suponitsky, Kyrill Yu.; Sivaev, Igor B.
Journal of publication	New Journal of Chemistry
Year of publication	2020
Journal volume	44
Journal issue	25
Pages of publication	10199 - 10202
a	13.4382 ± 0.0013 Å
b	14.3212 ± 0.0013 Å
c	19.229 ± 0.0018 Å
α	71.551 ± 0.002°
β	89.699 ± 0.002°
γ	75.284 ± 0.002°
Cell volume	3383.9 ± 0.6 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 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	0.1224
Residual factor for significantly intense reflections	0.0627
Weighted residual factors for significantly intense reflections	0.1422
Weighted residual factors for all reflections included in the refinement	0.1721
Goodness-of-fit parameter for all reflections included in the refinement	1.008
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/7059682.html