Crystallography Open Database

Information card for entry 2200821

2200820 << 2200821 >> 2200822

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Coordinates	Coordinates are not available: file is not found.
Structure factors	2200821.hkl
Original IUCr paper	HTML

Structure parameters

Chemical name	4^'^-{[benzoyl(4-nitrophenylhydrazono)methyl]sulfonyl}acetanilide
Formula	C22 H18 N4 O6 S
Calculated formula	C22 H18 N4 O6 S
SMILES	S(=O)(=O)(/C(=N\Nc1ccc(N(=O)=O)cc1)C(=O)c1ccccc1)c1ccc(NC(=O)C)cc1
Title of publication	4'-{[Benzoyl(4-nitrophenylhydrazono)methyl]sulfonyl}acetanilide
Authors of publication	Wojciech M. Wolf
Journal of publication	Acta Crystallographica Section E
Year of publication	2002
Journal volume	58
Journal issue	1
Pages of publication	o1 - o4
a	7.461 ± 0.001 Å
b	11.663 ± 0.002 Å
c	24.621 ± 0.005 Å
α	94.31 ± 0.03°
β	90.88 ± 0.03°
γ	94.01 ± 0.03°
Cell volume	2130.7 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1331
Residual factor for significantly intense reflections	0.0561
Weighted residual factors for significantly intense reflections	0.1328
Weighted residual factors for all reflections included in the refinement	0.18
Goodness-of-fit parameter for all reflections included in the refinement	1.065
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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