Crystallography Open Database

Information card for entry 7219533

7219532 << 7219533 >> 7219534

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Coordinates	7219533.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	(E)-N-phenyl-3-(3,4,5-trimethoxystyryl)pyridine-2-amine
Formula	C22 H22 N2 O3
Calculated formula	C22 H22 N2 O3
SMILES	c1(c(cccn1)/C=C/c1cc(c(c(c1)OC)OC)OC)Nc1ccccc1
Title of publication	Intramolecular Cyclization Assisted Oxidative Addition: Synthesis of Octahedral Cycloplatinated Methyl Complexes
Authors of publication	LIKHAR, PRAVIN R; D, Shankar; K, Jaipal; Balasubramanian, Sridhar; Lingamallu, Giribabu
Journal of publication	RSC Adv.
Year of publication	2015
a	7.269 ± 0.003 Å
b	7.994 ± 0.003 Å
c	32.597 ± 0.013 Å
α	90°
β	96.402 ± 0.001°
γ	90°
Cell volume	1882.3 ± 1.3 Å³
Cell temperature	294 ± 2 K
Ambient diffraction temperature	294 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0696
Residual factor for significantly intense reflections	0.0516
Weighted residual factors for significantly intense reflections	0.1209
Weighted residual factors for all reflections included in the refinement	0.1301
Goodness-of-fit parameter for all reflections included in the refinement	1.082
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
180526 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/95.	7219533.cif
131629	2015-02-10	cif/ Adding structures of 7219533 via cif-deposit CGI script.	7219533.cif