Crystallography Open Database

Information card for entry 4070730

Preview

Coordinates	4070730.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H66 Al N2 O Zr
Calculated formula	C49 H66 Al N2 O Zr
Title of publication	Organoaluminum Hydroxides Supported by β-Diketiminato Ligands: Synthesis, Structural Characterization, and Reactions
Authors of publication	Yang, Ying; Schulz, Thomas; John, Michael; Yang, Zhi; Jiménez-Pérez, Victor Manuel; Roesky, Herbert W.; Gurubasavaraj, Prabhuodeyara M.; Stalke, Dietmar; Ye, Hongqi
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	4
Pages of publication	769
a	37.4042 ± 0.0015 Å
b	12.8409 ± 0.0005 Å
c	19.3062 ± 0.0008 Å
α	90°
β	104.05°
γ	90°
Cell volume	8995.4 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0271
Residual factor for significantly intense reflections	0.0255
Weighted residual factors for significantly intense reflections	0.0672
Weighted residual factors for all reflections included in the refinement	0.0685
Goodness-of-fit parameter for all reflections included in the refinement	1.043
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
178596 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/07.	4070730.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4070730.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4070730.cif
42661	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4070726, 4070727, 4070728, 4070729, 4070730 via cif-deposit CGI script.	4070730.cif