Crystallography Open Database

Information card for entry 2000367

2000366 << 2000367 >> 2000368

Preview

Coordinates	2000367.cif
Original IUCr paper	HTML

Structure parameters

Formula	C12 H13 N O
Calculated formula	C12 H13 N O
SMILES	O=C1N[C@@H]2[C@H](C1)[C@H](c1ccccc21)C.O=C1N[C@H]2[C@@H](C1)[C@@H](c1ccccc21)C
Title of publication	Structures of three tricyclic γ-lactams
Authors of publication	Eggleston, D. S.; Baures, P. W.; Grabowska, U.; Marson, C. M.; Walsgrove, T.
Journal of publication	Acta Crystallographica Section C
Year of publication	1992
Journal volume	48
Journal issue	12
Pages of publication	2177 - 2181
a	14.589 ± 0.002 Å
b	8.33 ± 0.003 Å
c	8.186 ± 0.004 Å
α	90°
β	103.17 ± 0.02°
γ	90°
Cell volume	968.6 ± 0.6 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

Version history is temporarily not available due to server issues.