| Formula |
C12H16N2O2S2 |
| IUPAC Name |
(2r)-3-ethylsulfanyl-2-(phenylcarbamothioylamino)propanoic acid |
| Molecular Mass |
284.398 g·mol−1 |
| Heat of Formation |
-223.0 ± 16.7 kJ·mol−1 |
| Dipole Moment |
6.15 ± 1.08 D |
| Volume |
331.21 Å 3 |
| Surface Area |
302.03 Å 2 |
| HOMO Energy |
-8.39 ± 0.55 eV |
| LUMO Energy |
-0.35 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (2r)-3-(ethylthio)-2-(phenylthiocarbamoylamino)propionic acid
- (2r)-3-(ethylthio)-2-[[(phenylamino)-thioxomethyl]amino]propanoic acid
- phenylthiocarbamyl-s-ethylcysteine
- ptcsec
|
| CAS Number(s) |
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| InChIKey |
VXBLCJFXZZAMPK-JTQLQIEISA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
H
S
C
O
N
|
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