Crystallography Open Database

Information card for entry 4104576

Preview

Coordinates	4104576.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C280 H303 N46 O47.5 S2
Calculated formula	C280 H303 N45 O47.5 S2
Title of publication	Nanosized Hybrid Oligoamide Foldamers: Aromatic Templates for the Folding of Multiple Aliphatic Units
Authors of publication	David Sánchez-García; Brice Kauffmann; Takahiro Kawanami; Hirotaka Ihara; Makoto Takafuji; Marie-Hélène Delville; Ivan Huc
Journal of publication	Journal of the American Chemical Society
Year of publication	2009
Journal volume	131
Pages of publication	8642 - 8648
a	20.668 Å
b	24.598 Å
c	27.32 Å
α	79.04°
β	81.5°
γ	79.64°
Cell volume	13320.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1962
Residual factor for significantly intense reflections	0.1842
Weighted residual factors for significantly intense reflections	0.4528
Weighted residual factors for all reflections included in the refinement	0.4677
Goodness-of-fit parameter for all reflections included in the refinement	1.86
Diffraction radiation wavelength	0.8265 Å
Diffraction radiation type	synchrotronradiaition
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4104576.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4104576.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4104576.cif
29602	2011-11-04	../uploads/cif-deposit/cod/cif Adding structures of 4104576 via cif-deposit CGI script.	4104576.cif