Crystallography Open Database

Information card for entry 7020312

7020311 << 7020312 >> 7020313

Preview

Coordinates	7020312.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H52 Al N O
Calculated formula	C49 H52 Al N O
SMILES	[Al]1([N](c2c(cc(cc2C(c2ccccc2)c2ccccc2)C(C)C)C(c2ccccc2)c2ccccc2)=Cc2c(O1)c(cc(c2)C)C(C)(C)C)(C)C
Title of publication	Dimethylaluminium aldiminophenolates: synthesis, characterization and ring-opening polymerization behavior towards lactides.
Authors of publication	Zhang, Wenjuan; Wang, Youhong; Sun, Wen-Hua; Wang, Lin; Redshaw, Carl
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	38
Pages of publication	11587 - 11596
a	12.114 ± 0.002 Å
b	15.129 ± 0.003 Å
c	23.294 ± 0.005 Å
α	90°
β	99.69 ± 0.03°
γ	90°
Cell volume	4208.2 ± 1.5 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0976
Residual factor for significantly intense reflections	0.0844
Weighted residual factors for significantly intense reflections	0.1978
Weighted residual factors for all reflections included in the refinement	0.2118
Goodness-of-fit parameter for all reflections included in the refinement	1.236
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
179907 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/03.	7020312.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7020312.cif
71565	2013-01-20	cif/ Adding structures of 7020311, 7020312, 7020313 via cif-deposit CGI script.	7020312.cif