Crystallography Open Database

Information card for entry 4120996

4120995 << 4120996 >> 4120997

Preview

Coordinates	4120996.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H36 N8 O16 S2 Zn2
Calculated formula	C24 H36 N8 O16 S2 Zn2
Title of publication	Spontaneous Resolution to Absolute Chiral Induction: Pseudo-Kagomé Type Homochiral Zn(II)/Co(II) Coordination Polymers with Achiral Precursors
Authors of publication	Kamal Kumar Bisht; Eringathodi Suresh
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	15690 - 15693
a	29.75 ± 0.003 Å
b	9.313 ± 0.0008 Å
c	15.7483 ± 0.0014 Å
α	90°
β	102.096 ± 0.001°
γ	90°
Cell volume	4266.4 ± 0.7 Å³
Cell temperature	110 ± 2 K
Ambient diffraction temperature	110 ± 2 K
Number of distinct elements	6
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.0354
Residual factor for significantly intense reflections	0.033
Weighted residual factors for significantly intense reflections	0.083
Weighted residual factors for all reflections included in the refinement	0.084
Goodness-of-fit parameter for all reflections included in the refinement	1.027
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
178986 (current)	2016-03-22	cif/4/12/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/12/09.	4120996.cif
107169	2014-03-18	cif/ Adding structures of 4120996 via cif-deposit CGI script.	4120996.cif