Crystallography Open Database

Information card for entry 2003756

2003755 << 2003756 >> 2003757

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Coordinates	Coordinates are not available: file is not found.
Original IUCr paper	HTML

Structure parameters

Formula	C25 H25 N O2
Calculated formula	C25 H25 N O2
SMILES	O=C(N([C@H](C)c1ccccc1)[C@H](C)c1ccccc1)[C@H]1O[C@@H]1c1ccccc1
Title of publication	An Epoxyamide
Authors of publication	Clegg, W.; Ranelli, M.; Jackson, R. F. W.
Journal of publication	Acta Crystallographica Section C
Year of publication	1995
Journal volume	51
Journal issue	8
Pages of publication	1604 - 1606
a	9.8537 ± 0.001 Å
b	14.2586 ± 0.0013 Å
c	14.7465 ± 0.0014 Å
α	90°
β	90°
γ	90°
Cell volume	2071.9 ± 0.3 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	4
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0512
Residual factor for significantly intense reflections	0.048
Weighted residual factors for all reflections	0.151
Weighted residual factors for significantly intense reflections	0.1369
Goodness-of-fit parameter for all reflections	1.04
Goodness-of-fit parameter for significantly intense reflections	1.046
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

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