| Formula |
C16H19N3O3S2 |
| IUPAC Name |
(3s,6s)-3-(hydroxymethyl)-6-(1h-indol-3-ylmethyl)-3,6-bis(methylsulfanyl)piperazine-2,5-dione |
| Molecular Mass |
365.470 g·mol−1 |
| Heat of Formation |
-352.2 ± 16.7 kJ·mol−1 |
| Dipole Moment |
2.62 ± 1.08 D |
| Volume |
412.32 Å 3 |
| Surface Area |
323.52 Å 2 |
| HOMO Energy |
-8.57 ± 0.55 eV |
| LUMO Energy |
-0.54 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- (3s,6s)-3-(1h-indol-3-ylmethyl)-6-methylol-3,6-bis(methylthio)piperazine-2,5-quinone
- (3s,6s)-3-(hydroxymethyl)-6-(1h-indol-3-ylmethyl)-3,6-bis(methylthio)piperazine-2,5-dione
|
| InChIKey |
NOPTYKZKJYUDRQ-HOTGVXAUSA-N |
| QR Code |
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| Links |
PubChem
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|
| DOI |
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| Downloads |
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|
| Elements |
H
S
C
O
N
|
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