Crystallography Open Database

Information card for entry 7018055

Preview

Coordinates	7018055.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C73.5 H75 N7.5 O6
Calculated formula	C73.5 H75 N7.5 O6
Title of publication	1,3-Di-amidoquinoline conjugate of calix[4]arene (L) as a ratiometric and colorimetric sensor for Zn(2+): Spectroscopy, microscopy and computational studies.
Authors of publication	Mummidivarapu, V. V. Sreenivasu; Tabbasum, Khatija; Chinta, Jugun Prakash; Rao, Chebrolu P.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	6
Pages of publication	1671 - 1674
a	11.6535 ± 0.0004 Å
b	12.0093 ± 0.0004 Å
c	22.2811 ± 0.0013 Å
α	87.28 ± 0.004°
β	83.524 ± 0.004°
γ	86.494 ± 0.003°
Cell volume	3090 ± 0.2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.16
Residual factor for significantly intense reflections	0.0933
Weighted residual factors for significantly intense reflections	0.2309
Weighted residual factors for all reflections included in the refinement	0.2536
Goodness-of-fit parameter for all reflections included in the refinement	0.927
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7018055.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7018055.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7018055.cif
33579	2012-02-12	../uploads/cif-deposit/cod/cif Adding structures of 7018055 via cif-deposit CGI script.	7018055.cif