Crystallography Open Database

Information card for entry 1504479

Preview

Coordinates	1504479.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H27 N O4
Calculated formula	C24 H28 N O4
SMILES	O=C1N2[C@@]3(CC1)[C@](O)(/C(=C/c1ccccc1)C[C@@H]3CCCC2)C#CC(=O)OCC.O=C1N2[C@]3(CC1)[C@@](O)(/C(=C/c1ccccc1)C[C@H]3CCCC2)C#CC(=O)OCC
Title of publication	Total synthesis of (+/-)-stemonamide and (+/-)-isostemonamide using a radical cascade.
Authors of publication	Taniguchi, Tsuyoshi; Tanabe, Genzo; Muraoka, Osamu; Ishibashi, Hiroyuki
Journal of publication	Organic letters
Year of publication	2008
Journal volume	10
Journal issue	2
Pages of publication	197 - 199
a	11.147 ± 0.004 Å
b	18.976 ± 0.007 Å
c	9.467 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	2002.5 ± 1.2 Å³
Cell temperature	123 K
Number of distinct elements	4
Space group number	29
Hermann-Mauguin space group symbol	P c a 21
Hall space group symbol	P 2c -2ac
Residual factor for significantly intense reflections	0.1711
Weighted residual factors for all reflections included in the refinement	0.4527
Goodness-of-fit parameter for all reflections included in the refinement	1.132
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176435 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries from ranges 1, 2.	1504479.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1504479.cif
42098	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 1504479 via cif-deposit CGI script.	1504479.cif