Crystallography Open Database

Information card for entry 7700569

Preview

Coordinates	7700569.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H19 Al N2 O
Calculated formula	C16 H19 Al N2 O
Title of publication	Four- and five-coordinate aluminum complexes supported by N,O-bidentate β-pyrazylenolate ligands: synthesis, structure and application in ROP of ε-caprolactone and lactide.
Authors of publication	Qin, Lu; Zhang, Yue; Chao, Jianbin; Cheng, Jianhua; Chen, Xia
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	32
Pages of publication	12315 - 12325
a	7.2328 ± 0.0003 Å
b	21.793 ± 0.001 Å
c	9.96 ± 0.0005 Å
α	90°
β	106.2 ± 0.001°
γ	90°
Cell volume	1507.6 ± 0.12 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0522
Residual factor for significantly intense reflections	0.042
Weighted residual factors for significantly intense reflections	0.1172
Weighted residual factors for all reflections included in the refinement	0.1253
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
223927 (current)	2019-11-07	cif/ Updating files of 7700568, 7700569, 7700570, 7700571, 7700572, 7700573 Original log message: Adding full bibliography for 7700568--7700573.cif.	7700569.cif
217089	2019-07-17	cif/ Adding structures of 7700568, 7700569, 7700570, 7700571, 7700572, 7700573 via cif-deposit CGI script.	7700569.cif