Crystallography Open Database

Information card for entry 7111542

Preview

Coordinates	7111542.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H62 B2 La N3 O2
Calculated formula	C38 H62 B2 La N3 O2
Title of publication	Unusual reactivity of lanthanide borohydride complexes leading to a borane complex
Authors of publication	Meyer, Nils; Jenter, Jelena; Roesky, Peter W.; Eickerling, Georg; Scherer, Wolfgang
Journal of publication	Chemical Communications
Year of publication	2009
Journal issue	31
Pages of publication	4693 - 4695
a	16.0927 ± 0.0008 Å
b	25.1371 ± 0.0017 Å
c	19.9083 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	8053.4 ± 0.8 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0709
Residual factor for significantly intense reflections	0.034
Weighted residual factors for significantly intense reflections	0.0652
Weighted residual factors for all reflections included in the refinement	0.0723
Goodness-of-fit parameter for all reflections included in the refinement	0.864
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180229 (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 7/11/15.	7111542.cif
96646	2014-01-29	cif/ Adding structures of 7111542, 7111543 via cif-deposit CGI script.	7111542.cif