Crystallography Open Database

Information card for entry 8106024

Preview

Coordinates	8106024.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H39 N O5 Sn
Calculated formula	C23 H39 N O5 Sn
SMILES	[Sn]12(OCC([N]2=Cc2ccc(OCCCCCCCCCC)cc2O1)(CO)CO)(C)C
Title of publication	Crystal structure of (2-([1,1-bis(hydroxymethyl)-2-oxyethyl]iminomethyl)-5-(n-decyl)phenolato)-dimethyl-tin(IV), C23H39NO5Sn
Authors of publication	Lee, See Mun; Lo, Kong Mun; Tiekink, Edward R.T.
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2019
Journal volume	234
Journal issue	6
Pages of publication	1337 - 1340
a	6.0101 ± 0.0002 Å
b	9.2999 ± 0.0002 Å
c	22.311 ± 0.0006 Å
α	91.482 ± 0.002°
β	90.594 ± 0.003°
γ	102.631 ± 0.002°
Cell volume	1216.28 ± 0.06 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0446
Residual factor for significantly intense reflections	0.0425
Weighted residual factors for significantly intense reflections	0.1139
Weighted residual factors for all reflections included in the refinement	0.1158
Goodness-of-fit parameter for all reflections included in the refinement	1.054
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
279103 (current)	2022-11-08	cif/ Adding structures of 8106024 via cif-deposit CGI script.	8106024.cif