Crystallography Open Database

Information card for entry 7700230

Preview

Coordinates	7700230.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H32 B2 O4 Te
Calculated formula	C28 H32 B2 O4 Te
Title of publication	Using boryl-substitution and improved Suzuki-Miyaura cross-coupling to access new phosphorescent tellurophenes.
Authors of publication	Braun, Christina A.; Martinek, Nicole; Zhou, Yuqiao; Ferguson, Michael J.; Rivard, Eric
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	27
Pages of publication	10210 - 10219
a	12.0209 ± 0.0003 Å
b	12.9608 ± 0.0003 Å
c	18.3885 ± 0.0004 Å
α	86.3327 ± 0.001°
β	77.7639 ± 0.0009°
γ	69.4855 ± 0.0011°
Cell volume	2622.13 ± 0.11 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 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	0.0255
Residual factor for significantly intense reflections	0.022
Weighted residual factors for significantly intense reflections	0.0568
Weighted residual factors for all reflections included in the refinement	0.0597
Goodness-of-fit parameter for all reflections included in the refinement	1.016
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
223867 (current)	2019-11-07	cif/ Updating files of 7700228, 7700229, 7700230, 7700231 Original log message: Adding full bibliography for 7700228--7700231.cif.	7700230.cif
215802	2019-06-11	cif/ Adding structures of 7700228, 7700229, 7700230, 7700231 via cif-deposit CGI script.	7700230.cif