Crystallography Open Database

Information card for entry 4319981

4319980 << 4319981 >> 4319982

Preview

Coordinates	4319981.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C98 H72 B2 Cl4 F48 N12 Pb
Calculated formula	C98 H72 B2 Cl4 F48 N12 Pb
Title of publication	Control of the Stereochemical Impact of the Lone Pair in Lead(II) Tris(pyrazolyl)methane Complexes. Improved Preparation of Na{B[3,5-(CF3)2C6H3]4}
Authors of publication	Daniel L. Reger; Terri D. Wright; Christine A. Little; Jaydeep J. S. Lamba; Mark D. Smith
Journal of publication	Inorganic Chemistry
Year of publication	2001
Journal volume	40
Pages of publication	3810 - 3814
a	12.756 ± 0.004 Å
b	13.469 ± 0.004 Å
c	17.16 ± 0.005 Å
α	82.454 ± 0.007°
β	89.904 ± 0.008°
γ	72.995 ± 0.007°
Cell volume	2792.9 ± 1.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1401
Residual factor for significantly intense reflections	0.0661
Weighted residual factors for significantly intense reflections	0.1495
Weighted residual factors for all reflections included in the refinement	0.1699
Goodness-of-fit parameter for all reflections included in the refinement	1.013
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
179279 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/99.	4319981.cif
120093	2014-07-12	Adding DOIs to range 4/31 structures.	4319981.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4319981.cif
16786	2011-03-27	../uploads/cif-deposit/cod/cif Adding structures of 4319981 via cif-deposit CGI script.	4319981.cif