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p-aminobenzenesulfonamide-5-chloropyridine

Sample Originator: Terry L Threlfall, Simon J. Coles, Suzanna C Ward and Michael B. Hursthouse.

C11H10ClN3O2S

InChI=1/2C11H10ClN3O2S/c2*12-8-1-6-11(14-7-8)15-18(16,17)10-4-2-9(13)3-5-10/h2*1-7H,13H2,(H,14,15)

Identification Number:10.5258/ecrystals/175
Controlled Keywords:Structural systematics, sulfonamides, sulfur drugs
Date Created:23 April 1999
Deposited On:21 Jan 2008 15:29
Deposited By:A.N. Admin

Data collection parameters

Chemical formulaC11 H10 Cl N3 O2 S
Crystal morphology
Crystal systemMonoclinic
Space group symbolP2(1)/n
Cell length a12.476(2)
Cell length b14.045(3)
Cell length c15.134(3)
Cell angle alpha90.00
Cell angle beta109.33(3)
Cell angle gamma90.00
Data collection temperature150(2)

Refinement results

Solution figure of merit
R Factor (Obs)0.0598
R Factor (All)0.0820
Weighted R Factor (Obs)0.1640
Weighted R Factor (All)0.1770

Citation: Threlfall, Terry L and Coles, Simon J. and Ward, Suzanna C and Hursthouse, Michael B. (1999) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/175)
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Available Files

Final Result

99scw117.cif15k
99scw117.cml8k

Validation

99scw117_checkcif.htm9k

Refinement

99scw117.res7k
99scw117_xl.lst40k

Solution

99scw117.prp4k

Processing

99scw117.hkl673k

Other Files

99scw117.mol4k
99scw117_ellipsoid.gif20k

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