Crystallography Open Database

Information card for entry 2008308

2008307 << 2008308 >> 2008309

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Coordinates	2008308.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	N~1~,N~4~-Diformyl-t-5-methyl-r-2,t-3-diphenylpiperazine
Formula	C19 H20 N2 O2
Calculated formula	C19 H20 N2 O2
SMILES	N1([C@H](c2ccccc2)[C@H](N([C@H](C1)C)C=O)c1ccccc1)C=O.N1([C@@H](c2ccccc2)[C@@H](N([C@@H](C1)C)C=O)c1ccccc1)C=O
Title of publication	1,4-Diformyl-<i>t</i>-5-methyl-<i>r</i>-2,<i>t</i>-3-diphenylpiperazine-1,4-dicarbaldehyde
Authors of publication	Laavanya. P; Panchanatheswaran. K; Murugadoss. R; Jeyaraman. R
Journal of publication	Acta Crystallographica Section C
Year of publication	1999
Journal volume	55
Journal issue	3
Pages of publication	410 - 411
a	12.355 ± 0.003 Å
b	11.645 ± 0.003 Å
c	12.75 ± 0.003 Å
α	90°
β	117.407 ± 0.016°
γ	90°
Cell volume	1628.5 ± 0.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0748
Residual factor for significantly intense reflections	0.0627
Weighted residual factors for all reflections included in the refinement	0.2266
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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