Crystallography Open Database

Information card for entry 7111073

Preview

Coordinates	7111073.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H63 B3 Li6 N6
Calculated formula	C27 H63 B3 Li6 N6
Title of publication	A new route to dilithio boraamidinates: formation and X-ray structures of the dimeric and trimeric clusters {Li2[RB(NBut)2]}x (R = Bun, x = 2 and R = Me, x = 3)
Authors of publication	Brask, Justin K.; Chivers, Tristram; Schatte, Gabriele
Journal of publication	Chemical Communications
Year of publication	2000
Journal issue	18
Pages of publication	1805
a	17.3587 ± 0.0013 Å
b	12.075 ± 0.0008 Å
c	19.2718 ± 0.0014 Å
α	90°
β	116.073 ± 0.001°
γ	90°
Cell volume	3628.4 ± 0.4 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0842
Residual factor for significantly intense reflections	0.0611
Weighted residual factors for significantly intense reflections	0.1617
Weighted residual factors for all reflections included in the refinement	0.1775
Goodness-of-fit parameter for all reflections included in the refinement	1.051
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180224 (current)	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/10.	7111073.cif
96209	2014-01-29	cif/ Adding structures of 7111072, 7111073 via cif-deposit CGI script.	7111073.cif