Crystallography Open Database

Information card for entry 7212574

Preview

Coordinates	7212574.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H14 Ag Cl N6 O4
Calculated formula	C12 H14 Ag Cl N6 O4
Title of publication	Flexible “piperazine‒pyrazine” building blocks: conformational isomerism of “equatorial‒axial” sites toward the constructions of silver(i) coordination chains
Authors of publication	Hsu, Shu-Chun; Wu, Jing-Yun; Lee, Chin-Fen; Lee, Chung-Chou; Lai, Long-Li; Lu, Kuang-Lieh
Journal of publication	CrystEngComm
Year of publication	2010
Journal volume	12
Journal issue	11
Pages of publication	3388
a	28.677 ± 0.0005 Å
b	13.737 ± 0.0004 Å
c	18.424 ± 0.0004 Å
α	90°
β	123.91 ± 0.001°
γ	90°
Cell volume	6023.4 ± 0.3 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1008
Residual factor for significantly intense reflections	0.0495
Weighted residual factors for significantly intense reflections	0.1153
Weighted residual factors for all reflections included in the refinement	0.1541
Goodness-of-fit parameter for all reflections included in the refinement	1.037
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
180456 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/25.	7212574.cif
93108	2014-01-12	cif/ Adding structures of 7212572, 7212573, 7212574, 7212575 via cif-deposit CGI script.	7212574.cif