Crystallography Open Database

Information card for entry 4307790

Preview

Coordinates	4307790.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H23 B Cl N2 Sb
Calculated formula	C14 H23 B Cl N2 Sb
SMILES	[Sb]1(Cl)N(B(N1C(C)(C)C)c1ccccc1)C(C)(C)C
Title of publication	New Bonding Modes for Boraamidinate Ligands in Heavy Group 15 Complexes: Fluxional Behavior of the 1:2 Complexes, LiM[PhB(NtBu)2]2 (M = As, Sb, Bi)
Authors of publication	Jari Konu; Maravanji S. Balakrishna; Tristram Chivers; Thomas W. Swaddle
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	2627 - 2636
a	9.1398 ± 0.0018 Å
b	11.328 ± 0.002 Å
c	17.09 ± 0.003 Å
α	91.53 ± 0.03°
β	102.55 ± 0.03°
γ	90.16 ± 0.03°
Cell volume	1726.5 ± 0.6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.0383
Residual factor for significantly intense reflections	0.0333
Weighted residual factors for significantly intense reflections	0.0831
Weighted residual factors for all reflections included in the refinement	0.0862
Goodness-of-fit parameter for all reflections included in the refinement	1.139
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
179115 (current)	2016-03-23	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/77.	4307790.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4307790.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4307790.cif
1194	2010-06-06	cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory.	4307790.cif