Crystallography Open Database

Information card for entry 4504835

Preview

Coordinates	4504835.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H24 N O2
Calculated formula	C14 H24 N O2
Title of publication	Ascertaining the 1D Hydrogen-Bonded Network in Organic Ionic Solids
Authors of publication	Ballabh, Amar; Trivedi, Darshak R.; Dastidar, Parthasarathi
Journal of publication	Crystal Growth & Design
Year of publication	2005
Journal volume	5
Journal issue	4
Pages of publication	1545
a	8.552 ± 0.0011 Å
b	8.9702 ± 0.0012 Å
c	10.2765 ± 0.0014 Å
α	83.15 ± 0.002°
β	67.768 ± 0.002°
γ	70.608 ± 0.002°
Cell volume	688.32 ± 0.16 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0573
Residual factor for significantly intense reflections	0.0494
Weighted residual factors for significantly intense reflections	0.1323
Weighted residual factors for all reflections included in the refinement	0.1388
Goodness-of-fit parameter for all reflections included in the refinement	1.041
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
179583 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/48.	4504835.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4504835.cif
49986	2012-03-31	../uploads/cif-deposit/cod/cif Adding structures of 4504835 via cif-deposit CGI script.	4504835.cif