Crystallography Open Database

Information card for entry 4123820

Preview

Coordinates	4123820.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C106 H131 Ag2 B F4 Fe2 N4 O21 S
Calculated formula	C106 H131 Ag2 B F4 Fe2 N4 O21 S
Title of publication	Metal-Organic Nanotube with Helical and Propeller-Chiral Motifs Composed of a C10-Symmetric Double-Decker Nanoring.
Authors of publication	Yamagishi, Hiroshi; Fukino, Takahiro; Hashizume, Daisuke; Mori, Tadashi; Inoue, Yoshihisa; Hikima, Takaaki; Takata, Masaki; Aida, Takuzo
Journal of publication	Journal of the American Chemical Society
Year of publication	2015
Journal volume	137
Journal issue	24
Pages of publication	7628 - 7631
a	13.5851 ± 0.0013 Å
b	26.924 ± 0.003 Å
c	27.669 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	10120.4 ± 1.8 Å³
Cell temperature	90 K
Ambient diffraction temperature	90 K
Number of distinct elements	9
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	0.1854
Residual factor for significantly intense reflections	0.0877
Weighted residual factors for significantly intense reflections	0.222
Weighted residual factors for all reflections included in the refinement	0.2821
Goodness-of-fit parameter for all reflections included in the refinement	1.005
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
140128 (current)	2015-07-05	cif/ Updating files of 4123820 Original log message: Adding full bibliography for 4123820.cif.	4123820.cif
139148	2015-06-13	cif/ Adding structures of 4123820 via cif-deposit CGI script.	4123820.cif