Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C12H9N3O2S |
| Molecular Weight | 259.284 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC(C#N)=C(NC2=C(C=CC=C2)[N+]([O-])=O)S1
InChI
InChIKey=NPXUFPFFHANGDL-UHFFFAOYSA-N
InChI=1S/C12H9N3O2S/c1-8-6-9(7-13)12(18-8)14-10-4-2-3-5-11(10)15(16)17/h2-6,14H,1H3
Approval Year
PubMed
| Title | Date | PubMed |
|---|---|---|
| Cross-nucleation between ROY polymorphs. | 2005 Dec 14 |
|
| Analysis of conformational polymorphism in pharmaceutical solids using solid-state NMR and electronic structure calculations. | 2006 Apr 20 |
|
| Crystallization force--a density functional theory concept for revealing intermolecular interactions and molecular packing in organic crystals. | 2009 |
|
| Diffusion-controlled and "diffusionless" crystal growth near the glass transition temperature: relation between liquid dynamics and growth kinetics of seven ROY polymorphs. | 2009 Aug 21 |
|
| 2-(2-Nitro-anilino)-5,6,7,8-tetra-hydro-4H-cyclo-hepta-[b]thio-phene-3-carbonitrile. | 2010 May 15 |
|
| Polymorphism in molecular solids: an extraordinary system of red, orange, and yellow crystals. | 2010 Sep 21 |
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138564-59-7
Created by
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5-Methyl-2-((2-nitrophenyl)amino)-3-thiophenecarbonitrile
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DTXSID40160713
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1478312
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395460
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J7X181M78Y
Created by
admin on Fri Dec 15 16:29:22 GMT 2023 , Edited by admin on Fri Dec 15 16:29:22 GMT 2023
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SUBSTANCE RECORD
