Crystallography Open Database

Information card for entry 1541910

1541909 << 1541910 >> 1541911

Preview

Coordinates	1541910.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46.5 H71.5 N2.5 O9.5
Calculated formula	C46.5 H71.5 N2.5 O9.5
SMILES	O(C(=O)CCCCCCCCCCCCC)[C@H]1[C@@H](OC(=O)CCCCCCCCCCCCC)[C@@H](O[C@@H]1N1C(=O)NC(=O)C(=C1)c1oc2c(c1)cccc2)CO.O=CN(C)C
Title of publication	Hierarchical self-assembly of switchable nucleolipid supramolecular gels based on environmentally-sensitive fluorescent nucleoside analogs.
Authors of publication	Nuthanakanti, Ashok; Srivatsan, Seergazhi G.
Journal of publication	Nanoscale
Year of publication	2016
Journal volume	8
Journal issue	6
Pages of publication	3607 - 3619
a	8.615 ± 0.003 Å
b	11.124 ± 0.004 Å
c	25.315 ± 0.009 Å
α	101.343 ± 0.007°
β	91.424 ± 0.007°
γ	109.601 ± 0.006°
Cell volume	2229.9 ± 1.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	1
Hermann-Mauguin space group symbol	P 1
Hall space group symbol	P 1
Residual factor for all reflections	0.1361
Residual factor for significantly intense reflections	0.0652
Weighted residual factors for significantly intense reflections	0.1124
Weighted residual factors for all reflections included in the refinement	0.1372
Goodness-of-fit parameter for all reflections included in the refinement	0.958
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
177883 (current)	2016-03-05	cif/ Updating files of 1541907, 1541908, 1541909, 1541910 Original log message: Adding full bibliography for 1541907--1541910.cif.	1541910.cif
173553	2016-01-06	cif/ Adding structures of 1541910 via cif-deposit CGI script.	1541910.cif