Crystallography Open Database

Information card for entry 7229682

Preview

Coordinates	7229682.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H24 Ag2 I4 Mn N6
Calculated formula	C6 H24 Ag2 I4 Mn N6
Title of publication	Novel isomorphism of two hexagonal non-centrosymmetric hybrid crystals of M(en)3Ag2I4 (M = transition metal Mn2+ or main-group metal Mg2+; en = ethylenediamine)
Authors of publication	Chen, Xin; Yao, Zhi-Yuan; Xue, Chen; Yang, Zhu-Xi; Liu, Jian-Lan; Ren, Xiao-Ming
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	3
Pages of publication	356
a	9.1366 ± 0.0003 Å
b	9.1366 ± 0.0003 Å
c	14.4247 ± 0.0011 Å
α	90°
β	90°
γ	120°
Cell volume	1042.81 ± 0.09 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	6
Space group number	182
Hermann-Mauguin space group symbol	P 63 2 2
Hall space group symbol	P 6c 2c
Residual factor for all reflections	0.0186
Residual factor for significantly intense reflections	0.0181
Weighted residual factors for significantly intense reflections	0.0386
Weighted residual factors for all reflections included in the refinement	0.0388
Goodness-of-fit parameter for all reflections included in the refinement	1.199
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
229159 (current)	2019-11-17	cif/ Updating files of 7229682, 7229683 Original log message: Adding full bibliography for 7229682--7229683.cif.	7229682.cif
204098	2017-12-09	cif/ Adding structures of 7229682, 7229683 via cif-deposit CGI script.	7229682.cif