Crystallography Open Database

Information card for entry 4110628

Preview

Coordinates	4110628.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14.5 H17.5 Br Cu N8 O1.5 P
Calculated formula	C14.5 H18 Br Cu N8 O1.5 P
Title of publication	Cyclocarbophosphazene-Containing Tetrameric Assemblies Formed by the Mediation of P-O-P and P-O-Cu Linkages
Authors of publication	Vadapalli Chandrasekhar; Ramachandran Azhakar; Venkatasubbaiah Krishnan; Arunachalampillai Athimoolam; Balasubramanian Murugesa Pandian
Journal of publication	Journal of the American Chemical Society
Year of publication	2006
Journal volume	128
Pages of publication	6802 - 6803
a	19.93 ± 0.003 Å
b	19.93 ± 0.003 Å
c	14.509 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	5763 ± 2 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	84
Hermann-Mauguin space group symbol	P 42/m
Hall space group symbol	-P 4c
Residual factor for all reflections	0.107
Residual factor for significantly intense reflections	0.0583
Weighted residual factors for significantly intense reflections	0.1482
Weighted residual factors for all reflections included in the refinement	0.1623
Goodness-of-fit parameter for all reflections included in the refinement	0.9
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
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.	4110628.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4110628.cif
59428	2012-06-06	cif/ Adding structures of 4110628 via cif-deposit CGI script.	4110628.cif