N-Acetyl-S-{[(4-Cyanophenyl)Amino]Methyl}-L-Cysteine
Properties
Property | Value |
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Formula | C13H15N3O3S |
IUPAC Name | (2r)-2-acetamido-3-[(4-cyanoanilino)methylsulfanyl]propanoic acid |
Molecular Mass | 293.341 g·mol−1 |
Heat of Formation | -337.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.78 ± 1.08 D |
Volume | 344.83 Å 3 |
Surface Area | 324.56 Å 2 |
HOMO Energy | -8.88 ± 0.55 eV |
LUMO Energy | -0.76 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | YBDZQNQPSNNEHQ-LBPRGKRZSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |