Crystallography Open Database

Information card for entry 2100920

Preview

Coordinates	2100920.cif
Original IUCr paper	HTML

Structure parameters

Formula	C17 H17 N O6
Calculated formula	C17 H17 N O6
SMILES	O=C(N1[C@@H]2[C@@H]3O[C@H]([C@H]12)[C@@H]([C@H]3C(=O)OC)C(=O)OC)c1ccccc1.O=C(N1[C@H]2[C@H]3O[C@@H]([C@@H]12)[C@H]([C@@H]3C(=O)OC)C(=O)OC)c1ccccc1
Title of publication	Structures of four <i>N</i>-benzoylaziridine and aziridinium <i>p</i>-toluenesulfonate derivatives grafted onto 7-oxabicyclo[2.2.1]heptane skeletons
Authors of publication	Pinkerton, A. A.; Gallacher, A. C.; Radil, M.; Kunze, A.; Allemann, S.; Vogel, P.
Journal of publication	Acta Crystallographica Section B
Year of publication	1993
Journal volume	49
Journal issue	2
Pages of publication	328 - 334
a	5.362 ± 0.001 Å
b	24.558 ± 0.003 Å
c	11.793 ± 0.001 Å
α	90°
β	96.42 ± 0.01°
γ	90°
Cell volume	1543.2 ± 0.4 Å³
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	Mo
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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