Crystallography Open Database

Information card for entry 4336081

Preview

Coordinates	4336081.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H48 B2 Li2 N8 O4
Calculated formula	C28 H48 B2 Li2 N8 O4
Title of publication	Synthesis and Structural Characterization of Bis(2-oxoimidazolyl)hydroborato Complexes: A New Class of Bidentate Oxygen-Donor Ligands
Authors of publication	Ahmed Al-Harbi; Yi Rong; Gerard Parkin
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	10226 - 10228
a	9.7018 ± 0.0013 Å
b	11.7027 ± 0.0016 Å
c	15.355 ± 0.002 Å
α	101.55 ± 0.002°
β	100.886 ± 0.002°
γ	96.742 ± 0.002°
Cell volume	1655.4 ± 0.4 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1044
Residual factor for significantly intense reflections	0.0526
Weighted residual factors for significantly intense reflections	0.0806
Weighted residual factors for all reflections included in the refinement	0.0934
Goodness-of-fit parameter for all reflections included in the refinement	1.142
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
179463 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/60.	4336081.cif
102051	2014-02-19	cif/ Adding structures of 4336081 via cif-deposit CGI script.	4336081.cif