Crystallography Open Database

Information card for entry 4117469

Preview

Coordinates	4117469.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H84 Ag14 Cl N O3
Calculated formula	C60 H84 Ag14 Cl N O3
Title of publication	Enlargement of Globular Silver Alkynide Cluster via Core Transformation
Authors of publication	Sam C. K. Hau; Ping-Shing Cheng; Thomas C. W. Mak
Journal of publication	Journal of the American Chemical Society
Year of publication	2012
Journal volume	134
Pages of publication	2922 - 2925
a	21.4318 ± 0.0009 Å
b	21.4318 ± 0.0009 Å
c	13.767 ± 0.0006 Å
α	90°
β	90°
γ	120°
Cell volume	5476.3 ± 0.4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0269
Residual factor for significantly intense reflections	0.0259
Weighted residual factors for significantly intense reflections	0.0654
Weighted residual factors for all reflections included in the refinement	0.0662
Goodness-of-fit parameter for all reflections included in the refinement	1.089
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
178945 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/74.	4117469.cif
74568	2013-03-01	cif/ Adding structures of 4117469 via cif-deposit CGI script.	4117469.cif