Crystallography Open Database

Information card for entry 1503928

Preview

Coordinates	1503928.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	all-anti-Pentatetrahydrofuran
Chemical name	all-anti-2,3,4-5-Tetrakis(tetrahydrofuro)furan
Formula	C12 H12 O5
Calculated formula	C12 H12 O5
SMILES	O1[C@H]2O[C@@H]3OC=C[C@@H]3[C@H]2[C@H]2[C@@H]1O[C@@H]1OC=C[C@H]21
Title of publication	anti-Oligoannelated THF moieties: synthesis via push-pull-substituted cyclopropanes.
Authors of publication	Schneider, Tobias F.; Kaschel, Johannes; Dittrich, Birger; Werz, Daniel B.
Journal of publication	Organic letters
Year of publication	2009
Journal volume	11
Journal issue	11
Pages of publication	2317 - 2320
a	6.1208 ± 0.0007 Å
b	9.984 ± 0.002 Å
c	17.437 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	1065.6 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	3
Space group number	20
Hermann-Mauguin space group symbol	C 2 2 21
Hall space group symbol	C 2c 2
Residual factor for all reflections	0.0422
Residual factor for significantly intense reflections	0.0293
Weighted residual factors for all reflections included in the refinement	0.0379
Goodness-of-fit parameter for all reflections included in the refinement	1.6922
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1503928.cif
91932	2013-12-28	cif/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the range 1 CIFs.	1503928.cif
39198	2012-03-07	../uploads/cif-deposit/cod/cif Adding structures of 1503927, 1503928, 1503929 via cif-deposit CGI script.	1503928.cif