Crystallography Open Database

Information card for entry 7024902

Preview

Coordinates	7024902.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C7 H10 Cu3 I4 N
Calculated formula	C7 H10 Cu3 I4 N
Title of publication	In situ alkylation of N-heterocycles in organic templated cuprous halides.
Authors of publication	Hou, Juan-Juan; Li, Shi-Li; Li, Cui-Rui; Zhang, Xian-Ming
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	10
Pages of publication	2701 - 2707
a	18.483 ± 0.003 Å
b	11.8808 ± 0.0016 Å
c	6.8857 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	1512.1 ± 0.4 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	46
Hermann-Mauguin space group symbol	I m a 2
Hall space group symbol	I 2 -2a
Residual factor for all reflections	0.0597
Residual factor for significantly intense reflections	0.0438
Weighted residual factors for significantly intense reflections	0.1214
Weighted residual factors for all reflections included in the refinement	0.1895
Goodness-of-fit parameter for all reflections included in the refinement	1.18
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
179954 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/49.	7024902.cif
92733	2014-01-12	cif/ Adding structures of 7024902, 7024903, 7024904, 7024905, 7024906 via cif-deposit CGI script.	7024902.cif