Crystallography Open Database

Information card for entry 4303126

Preview

Coordinates	4303126.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H65 N3 O2 Pb
Calculated formula	C44 H65 N3 O2 Pb
SMILES	[Pb]1(N(C(=CC(=[N]1c1c(cccc1C(C)C)C(C)C)C)C)c1c(cccc1C(C)C)C(C)C)N(c1ccccc1)C(=O)OC(C)C.CCCCC
Title of publication	Carbon Dioxide Activation by "Non-nucleophilic" Lead Alkoxides
Authors of publication	Eric C. Y. Tam; Nick C. Johnstone; Lorenzo Ferro; Peter B. Hitchcock; J. Robin Fulton
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	8971 - 8976
a	11.5616 ± 0.0003 Å
b	11.6261 ± 0.0003 Å
c	18.2619 ± 0.0004 Å
α	102.146 ± 0.001°
β	95.723 ± 0.002°
γ	112.814 ± 0.001°
Cell volume	2166.78 ± 0.1 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0565
Residual factor for significantly intense reflections	0.0406
Weighted residual factors for significantly intense reflections	0.0833
Weighted residual factors for all reflections included in the refinement	0.0901
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation probe	x-ray
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
179069 (current)	2016-03-22	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/31.	4303126.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4303126.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4303126.cif
1125	2010-04-25	cif/4/ Adding CIFs for the Inorg-Chem-2009_11-24 deposition.	4303126.cif