Crystallography Open Database

Information card for entry 1502677

Preview

Coordinates	1502677.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H42 N2 O2
Calculated formula	C24 H42 N2 O2
SMILES	[C@H]1(C[C@@H](CC[C@H]1C(C)C)C)O.c1(cccc(c1NC(=O)CN(CC)CC)C)C
Title of publication	Lidocaine/L-menthol binary system: cocrystallization versus solid-state immiscibility.
Authors of publication	Corvis, Yohann; Négrier, Philippe; Lazerges, Mathieu; Massip, Stéphane; Léger, Jean-Michel; Espeau, Philippe
Journal of publication	The journal of physical chemistry. B
Year of publication	2010
Journal volume	114
Journal issue	16
Pages of publication	5420 - 5426
a	8.4016 ± 0.0005 Å
b	13.4207 ± 0.0009 Å
c	22.13 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	2495.3 ± 0.3 Å³
Cell temperature	233 ± 2 K
Ambient diffraction temperature	233 ± 2 K
Number of distinct elements	4
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0705
Residual factor for significantly intense reflections	0.0485
Weighted residual factors for significantly intense reflections	0.1151
Weighted residual factors for all reflections included in the refinement	0.1225
Goodness-of-fit parameter for all reflections included in the refinement	1.011
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1502677.cif
91932	2013-12-28	cif/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the range 1 CIFs.	1502677.cif
36631	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 1502677 via cif-deposit CGI script.	1502677.cif